text
stringlengths 25
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int64 0
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|---|---|
COc1ccccc1.ClCC(Cl)(Cl)Cl.O=C(Cl)c1ccc(F)c(F)c1.[Cl-]~[Cl-]~[Zn+2]>>COc1ccc(C(=O)c2ccc(F)c(F)c2)cc1 | 61 |
C1CCCCC1.CC(C)(CO)CCl.C[Si](C)(C)Cl.c1c[nH]cn1>>CC(C)(CCl)CO[Si](C)(C)C | 193 |
CC(C)N1Cc2c(-n3c(=O)cc(C(F)(F)F)[nH]c3=O)ccc(Cl)c2C1=O.CI.CN(C)C=O.O.O=C([O-])[O-]~[K+]~[K+]>>CC(C)N1Cc2c(-n3c(=O)cc(C(F)(F)F)n(C)c3=O)ccc(Cl)c2C1=O | 570 |
BrCc1ccccc1.C1COCCOCCOCCOCCOCCO1.CC(C)(C)[O-]~[K+].CCOC(C)O[C@H]1CC[C@]2(C)C3=C(CC[C@H]2C1(C)C)C1=CC[C@H]([C@@H](C)O)[C@@]1(C)CC3.Cc1ccccc1.O>>CCOC(C)O[C@H]1CC[C@]2(C)C3=C(CC[C@H]2C1(C)C)C1=CC[C@H]([C@@H](C)OCc2ccccc2)[C@@]1(C)CC3 | 464 |
BrB(Br)Br.COC(=O)C1Cc2ccc(OC)cc2C1.ClCCl>>COC(=O)C1Cc2ccc(O)cc2C1 | 48 |
C1COCCO1~O.CC(C)(C)OC(=O)N1CCc2cc(Br)c(F)cc21.Cl[Pd]Cl~[Fe+2]~c1ccc(P(c2ccccc2)[c-]2cccc2)cc1~c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.Cn1cc(B2OC(C)(C)C(C)(C)O2)cn1.O=C([O-])[O-]~[K+]~[K+]>>Cn1cc(-c2cc3c(cc2F)N(C(=O)OC(C)(C)C)CC3)cn1 | 971 |
CC(=O)O.CCOC(C)=O.CO.COC(=O)[C@@H]1CCC[C@@H]1N.Cc1cccc(C=O)c1.O=C([O-])O.[BH3-]C#N.[Na+].[Na+]>>COC(=O)[C@@H]1CCC[C@@H]1NCc1cccc(C)c1 | 468 |
C1CCOC1.CC(C)(C)c1ccccc1N1CCNCC1~Cl~Cl.CCN(CC)CC.CCOC(=O)CCN=C=O.O>>CCOC(=O)CCNC(=O)N1CCN(c2ccccc2C(C)(C)C)CC1 | 437 |
C1CCOC1~O.COC(=O)CCNC(=O)c1ccc(N2CCCCC2=O)cc1.Cl.[Li+]~[OH-]>>O=C(O)CCNC(=O)c1ccc(N2CCCCC2=O)cc1 | 88 |
CCO.O=C1C2CC2(c2ccc([N+](=O)[O-])cc2)C(=O)N1CC1CCCCC1.[Pd]>>Nc1ccc(C23CC2C(=O)N(CC2CCCCC2)C3=O)cc1 | 1 |
BrBr.CC(=O)c1ccc(OCc2ccccc2)c([N+](=O)[O-])c1.ClC(Cl)Cl>>O=C(CBr)c1ccc(OCc2ccccc2)c([N+](=O)[O-])c1 | 173 |
CO.COC(=O)c1nc(-c2ccc(S(C)(=O)=O)cc2)cnc1N.Cl.O.[Li+]~[OH-]>>CS(=O)(=O)c1ccc(-c2cnc(N)c(C(=O)O)n2)cc1 | 152 |
CC(C)O.CCOC(=O)N1CCC(Nc2ccccn2)CC1.[K+].[OH-]>>c1ccc(NC2CCNCC2)nc1 | 283 |
C1COCCO1.CCOC(=O)c1c(NS(=O)(=O)c2ccc(F)cc2)sc2c1CCCC2.O.O.[Li+].[OH-]>>O=C(O)c1c(NS(=O)(=O)c2ccc(F)cc2)sc2c1CCCC2 | 171 |
C1CCOC1.O=C(c1ccc(OCCN2CCCCC2)cc1)c1c(-c2ccc(F)cc2F)ccc2cc(O)ccc12.[Al+3]~[H-]~[H-]~[H-]~[H-]~[Li+]>>Oc1ccc2c(C(O)c3ccc(OCCN4CCCCC4)cc3)c(-c3ccc(F)cc3F)ccc2c1 | 157 |
CS(=O)(=O)Cl.C[C@H](Cn1ccc(-c2ccc(C#N)c(Cl)c2)n1)NC(=O)c1csc(C2CCNCC2)n1.ClCCl.O.c1ccncc1>>C[C@H](Cn1ccc(-c2ccc(C#N)c(Cl)c2)n1)NC(=O)c1csc(C2CCN(S(C)(=O)=O)CC2)n1 | 584 |
C1CCOC1.COC(=O)c1ccc2nc(-c3cc4cc(Cl)ccc4o3)c(N(C)C(C)C)nc2c1.O.[Na+].[OH-]>>CC(C)N(C)c1nc2cc(C(=O)O)ccc2nc1-c1cc2cc(Cl)ccc2o1 | 247 |
CC(=O)C1CNC1~Cl.CCN(C(C)C)C(C)C.CCN=C=NCCCN(C)C.CN(C)C=O.CN1CCC2(CC1)Cc1cc(/C=C/C(=O)O)cnc1NC2=O~Cl.On1nnc2ccccc21>>CC(=O)C1CN(C(=O)/C=C/c2cnc3c(c2)CC2(CCN(C)CC2)C(=O)N3)C1 | 811 |
Cl~NO.O=C1CCN(Cc2nc3ccccc3[nH]2)CC1>>ON=C1CCN(Cc2nc3ccccc3[nH]2)CC1 | 86 |
C1CCOC1.NC1CCN(Cc2ccccc2)CC1.O=C(OC(=O)C(F)(F)F)C(F)(F)F.c1ccncc1>>O=C(NC1CCN(Cc2ccccc2)CC1)C(F)(F)F | 316 |
C1CCNCC1.CCO.CN(C)CCOc1ccc2[nH]c(C=O)cc2c1.O=C1Cc2cc(-c3ccccc3)ccc2N1>>CN(C)CCOc1ccc2[nH]c(C=C3C(=O)Nc4ccc(-c5ccccc5)cc43)cc2c1 | 440 |
CI.CN(C)C=O.C[C@@H]1C[C@H](O)CCN1[C@H](C)c1ccccc1.O.[H-].[Na+]>>CO[C@@H]1CCN([C@H](C)c2ccccc2)[C@H](C)C1 | 140 |
CCOC(C)=O.Cl[Sn](Cl)(Cl)Cl.N#Cc1ncc([N+](=O)[O-])cc1Cl.O=C([O-])O~[Na+]>>N#Cc1ncc(N)cc1Cl | 269 |
C1CCOC1.O=C(N=NC(=O)OCc1ccccc1)OCc1ccccc1.OC1CCCCC1.Oc1ccc2[nH]ncc2c1.c1ccc(P(c2ccccc2)c2ccccc2)cc1>>c1cc2[nH]ncc2cc1OC1CCCCC1 | 846 |
C1CCOC1.CO.Cc1ccc(N2CCN(C)CC2)c(CO)c1.ClC(Cl)Cl.[Mn+4]~[O-2]~[O-2]>>Cc1ccc(N2CCN(C)CC2)c(C=O)c1 | 179 |
Cl.Cn1cc(C(=O)CC(c2ccc(CO)cc2)c2ccc(Cl)cc2F)ccc1=O.NO.O=C([O-])O.[Na+]>>Cn1cc(/C(CC(c2ccc(CO)cc2)c2ccc(Cl)cc2F)=N/O)ccc1=O | 966 |
CCN(CC)CC.COC(=O)[C@H](CC1CCC(O)CC1)NC(=O)OC(C)(C)C.CS(C)=O.ClCCl.O=C(Cl)C(=O)Cl.O=C([O-])O~[Na+]>>COC(=O)[C@H](CC1CCC(=O)CC1)NC(=O)OC(C)(C)C | 87 |
CCO.CO.COc1cnc2nccc(N3CCN(CCN)CC3)c2c1.ClC(Cl)Cl.ClCCl.O=Cc1ccc2c(n1)NC(=O)CS2.O=S(=O)([O-])[O-].[BH4-].[Na+].[Na+].[Na+]>>COc1cnc2nccc(N3CCN(CCNCc4ccc5c(n4)NC(=O)CS5)CC3)c2c1 | 775 |
C1CCC(OCC2CCNCC2)OC1.CC(=O)[O-].CC(=O)[O-].CC(C)(C)O[Na].Cc1ccccc1.FC(F)(F)c1ccc(C(F)(F)F)c(Br)c1.[Pd+2].c1ccc(P(c2ccccc2)c2ccc3ccccc3c2-c2c(P(c3ccccc3)c3ccccc3)ccc3ccccc23)cc1>>FC(F)(F)c1ccc(C(F)(F)F)c(N2CCC(COC3CCCCO3)CC2)c1 | 294 |
CCN(C(C)C)C(C)C.CN(C)C(On1nnc2cccnc21)=[N+](C)C~F[P-](F)(F)(F)(F)F.CN(C)C=O.CN~Cl.COc1cc2c(CCNC(C)=O)c(C(=O)O)[nH]c2cc1F>>CNC(=O)c1[nH]c2cc(F)c(OC)cc2c1CCNC(C)=O | 137 |
CON.Cl.O=C(c1ccc(Cl)cc1)C1CC1.c1ccncc1>>CON=C(c1ccc(Cl)cc1)C1CC1 | 212 |
CC#N.CCOC(=O)CC(=O)c1cc(F)c(F)c(F)c1F.CN(C)CC1CNCCO1.O=C([O-])O~[Na+]>>CCOC(=O)CC(=O)c1cc(F)c(N2CCOC(CN(C)C)C2)c(F)c1F | 26 |
CN(C)C(On1nnc2cccnc21)=[N+](C)C~F[P-](F)(F)(F)(F)F.ClCCl.N#CCC(=O)O.Nc1ncnc2c1c(-c1ccc(Oc3cccc(F)c3F)cc1F)nn2C[C@@H]1CCCN1.O>>N#CCC(=O)N1CCC[C@H]1Cn1nc(-c2ccc(Oc3cccc(F)c3F)cc2F)c2c(N)ncnc21 | 146 |
CC(C)(C)OC(=O)OC(=O)OC(C)(C)C.CCN(CC)CC.ClCCl.N#Cc1ccccc1Cn1c(=O)n(Cc2ccccc2)c2c(N3CCNCC3)nccc21>>CC(C)(C)OC(=O)N1CCN(c2nccc3c2n(Cc2ccccc2)c(=O)n3Cc2ccccc2C#N)CC1 | 694 |
BrC1CCCC1.CCOC(C)=O.CN(C)C=O.COc1cc(S(=O)(=O)N[C@@H]2CC[C@@H](C(=O)N[C@H](C)c3ccc(F)cc3)CC2)ccc1O.O=C([O-])[O-]~[K+]~[K+]>>COc1cc(S(=O)(=O)N[C@@H]2CC[C@@H](C(=O)N[C@H](C)c3ccc(F)cc3)CC2)ccc1OC1CCCC1 | 153 |
COc1ccccc1.Cc1ccc(C(=O)Cl)cc1.ClCCl.[Al+3].[Cl-].[Cl-].[Cl-]>>COc1ccc(C(=O)c2ccc(C)cc2)cc1 | 61 |
CC#N.CCOC(=O)C1(C)CCC2(CC1)OCCO2.O.O=[N+]([O-])[O-]~[Ce]~[NH4+]>>CCOC(=O)C1(C)CCC(=O)CC1 | 251 |
C1CCOC1.CCCC[N+](CCCC)(CCCC)CCCC~[F-].COc1ccc(NC(=O)CC(F)(F)F)c(CO[Si](C)(C)C(C)(C)C)c1>>COc1ccc(NC(=O)CC(F)(F)F)c(CO)c1 | 708 |
Br~Nc1nc(-c2cc([N+](=O)[O-])ccc2Cl)cs1.O=S(=O)(Cl)c1c(Cl)cc(Cl)cc1Cl>>O=[N+]([O-])c1ccc(Cl)c(-c2csc(NS(=O)(=O)c3c(Cl)cc(Cl)cc3Cl)n2)c1 | 637 |
CC(C)=C(Cl)N(C)C.CN(C)C=O.COC(=O)[C@@H]1CCC[C@H](C(=O)O)C1.Nc1cc(-c2ccc3ncn(CC4CCOCC4)c3c2)c(Cl)cn1.O.c1ccncc1>>COC(=O)[C@H]1CCC[C@@H](C(=O)Nc2cc(-c3ccc4ncn(CC5CCOCC5)c4c3)c(Cl)cn2)C1 | 368 |
C1CCOC1~CO.COC(=O)c1ccccc1-n1c(C)cc(C(=O)Nc2ccc(S(C)(=O)=O)cc2)c1C.O.[Li+]~[OH-]>>Cc1cc(C(=O)Nc2ccc(S(C)(=O)=O)cc2)c(C)n1-c1ccccc1C(=O)O | 247 |
CCO.CCOC(=O)c1cccc(Nc2c(C(N)=O)cnc3cc(-c4cc(C)nc(Cl)c4)ccc23)c1.[Na+].[OH-]>>Cc1cc(-c2ccc3c(Nc4cccc(C(=O)O)c4)c(C(N)=O)cnc3c2)cc(Cl)n1 | 5 |
CCOC(=O)c1ncc2c(cc(C#N)n2Cc2cccc(F)c2)c1O.CO~C[O-]~[Na+].NCC(=O)O>>N#Cc1cc2c(O)c(C(=O)NCC(=O)O)ncc2n1Cc1cccc(F)c1 | 977 |
CN(C)C=O.N#Cc1ccc(F)cc1.O=C([O-])[O-].Oc1ccc(Br)cc1.[K+].[K+]>>N#Cc1ccc(Oc2ccc(Br)cc2)cc1 | 564 |
CC(C)Cc1cc(Cl)c2nc(-c3nc(-c4cc(F)c(CCC(=O)OC(C)(C)C)cc4Cl)no3)cn2c1.O=C(O)C(F)(F)F>>CC(C)Cc1cc(Cl)c2nc(-c3nc(-c4cc(F)c(CCC(=O)O)cc4Cl)no3)cn2c1 | 278 |
CN(C)c1ccncc1.COc1cc2nccc(Cl)c2cc1OC.Clc1ccccc1Cl.Oc1ccc2ncsc2c1I>>COc1cc2nccc(Oc3ccc4ncsc4c3I)c2cc1OC | 351 |
CC(C)(C)OC(=O)N1CC=C(c2ccc(C(F)(F)F)cc2)CC1.CCO.[Pd]>>CC(C)(C)OC(=O)N1CCC(c2ccc(C(F)(F)F)cc2)CC1 | 806 |
C1CCOC1.COC(=O)CC1C(=O)Nc2ccccc2N1S(=O)(=O)c1ccc(Cl)c(Cl)c1.O.[Li+].[OH-]>>O=C(O)CC1C(=O)Nc2ccccc2N1S(=O)(=O)c1ccc(Cl)c(Cl)c1 | 88 |
CN1CCC[C@@H]1Cc1c[nH]c2ccc(C=CCCO)cc12.ClCCl.[Pd]>>CN1CCC[C@@H]1Cc1c[nH]c2ccc(CCCCO)cc12 | 362 |
CC(C)c1nsc(N2CCC(N)CC2)n1.CCN(C(C)C)C(C)C.CCN=C=NCCCN(C)C.CN(C)C=O.CSCC[C@H](NC(=O)OC(C)(C)C)C(=O)O.Cl.O.On1nnc2ccccc21>>CSCC[C@H](NC(=O)OC(C)(C)C)C(=O)NC1CCN(c2nc(C(C)C)ns2)CC1 | 230 |
CCCCCCc1ccc(-c2nnc(-c3ccc(OC(C)=O)c(F)c3)s2)cc1.CCO.Cl.[K+].[OH-]>>CCCCCCc1ccc(-c2nnc(-c3ccc(O)c(F)c3)s2)cc1 | 22 |
C(=NC1CCCCC1)=NC1CCCCC1.CCCCCCCC/C=C\CCCCCCCC(=O)O.Nc1ccncc1>>CCCCCCCC/C=C\CCCCCCCC(=O)Nc1ccncc1 | 365 |
C1CCOC1.Nc1ncccc1C(=O)O.O.O.O.O.O.O.O.O.O.O.O=S(=O)([O-])[O-].[Al+3].[H-].[H-].[H-].[H-].[Li+].[Na+].[Na+]>>Nc1ncccc1CO | 293 |
ClCCl.N#Cc1cccc(C(ON2C(=O)c3ccccc3C2=O)C(=O)N2CCOCC2)c1.NN.O>>N#Cc1cccc(C(ON)C(=O)N2CCOCC2)c1 | 452 |
CCOC(=O)C(C)C(c1ccc(Cl)cc1)c1c[nH]c2c(CSC)cccc12.CSCc1cccc2c(C(CCO)c3cnc(Br)s3)c[nH]c12>>CSCc1cccc2c(C(c3ccc(Cl)cc3)C(C)CO)c[nH]c12 | 225 |
CN.CN(C)C=O.CN(CC[C@@H]1CC[C@@H](C(=O)N(C)CCC(=O)O)CC1)C(=O)Oc1ccc(Cl)cc1.ClCCl.O=C(Cl)C(=O)Cl>>CNC(=O)CCN(C)C(=O)[C@@H]1CC[C@@H](CCN(C)C(=O)Oc2ccc(Cl)cc2)CC1 | 230 |
CO.N#N.O=C(O)c1cc(F)c(Br)cc1F.O=S(=O)(O)O>>COC(=O)c1cc(F)c(Br)cc1F | 33 |
C1COCCO1.CCN(C(C)C)C(C)C.O=C(Nc1ccc(C2CCNCC2)cc1)c1cc(-c2ccccc2)cs1.O=C(O)c1ccc(F)nc1>>O=C(O)c1ccc(N2CCC(c3ccc(NC(=O)c4cc(-c5ccccc5)cs4)cc3)CC2)nc1 | 756 |
C1CCNCC1.CCN(C(C)C)C(C)C.CN(C)C(On1nnc2ccccc21)=[N+](C)C~F[B-](F)(F)F.CN(C)C=O.O=C(O)c1ccc2cc(O)ccc2c1>>O=C(c1ccc2cc(O)ccc2c1)N1CCCCC1 | 44 |
CC(C)(C#N)N=NC(C)(C)C#N.Cc1ncccc1C#N.ClC(Cl)(Cl)Cl.O=C1CCC(=O)N1Br>>N#Cc1cccnc1CBr | 590 |
C1CCOC1.CC(C)(C)OC(=O)NC1(c2ccc(C(C)(C)N)o2)CC1.O.O=C(Cl)OCc1ccccc1>>CC(C)(C)OC(=O)NC1(c2ccc(C(C)(C)NC(=O)OCc3ccccc3)o2)CC1 | 479 |
CN1C(=O)CC(=O)N(c2ccccc2)c2cc(Cl)ccc21.CO.[K+].[OH-]>>CN1C(=O)CC(=O)N(c2ccccc2)c2ccccc21 | 253 |
C1COCCN1.CC#N.CCN(CC)CC.CCOC(=O)Cl.O=C(O)C1CC(O)CN1C(=O)c1ccc2c(c1)OCO2>>O=C(C1CC(O)CN1C(=O)c1ccc2c(c1)OCO2)N1CCOCC1 | 685 |
C=CCc1cc(OCCCC)ccc1O.CN(C)CCCCl.Cc1ccccc1.[H-].[Na+]>>C=CCc1cc(OCCCC)ccc1OCCCN(C)C | 74 |
CN1CCCC1=O.Cc1c[nH]c2cccc(OCc3ccccc3)c12.I[Cu]I.O=C([O-])[O-]~[K+]~[K+].Oc1ccc(Br)cc1F>>Cc1cn(-c2ccc(O)c(F)c2)c2cccc(OCc3ccccc3)c12 | 349 |
CCN(C(C)C)C(C)C.CN(C)C(On1nnc2ccccc21)=[N+](C)C~F[B-](F)(F)F.CN(C)C=O.O=C(O)CCc1ccc(O)cc1.O=C([O-])O~[Na+].c1ccc2c(c1)CCNC2>>O=C(CCc1ccc(O)cc1)N1CCc2ccccc2C1 | 633 |
CC(C)(C)OC(=O)OC(=O)OC(C)(C)C.ClCCl.Cl~NCc1nccc(Cl)n1.O=C([O-])O~[Na+]>>CC(C)(C)OC(=O)NCc1nccc(Cl)n1 | 631 |
CCOC(=O)Cc1csc(N)n1.COc1ccc(OC)c(S(=O)(=O)Cl)c1>>CCOC(=O)Cc1csc(NS(=O)(=O)c2cc(OC)ccc2OC)n1 | 637 |
C1CCOC1.CO.COC(=O)c1cccc(NC(=O)Nc2ccc(-c3csc4ncnc(N)c34)cc2)c1.Cl.O.O~[Cl-]~[Na+].[Na+]~[OH-]>>Nc1ncnc2scc(-c3ccc(NC(=O)Nc4cccc(C(=O)O)c4)cc3)c12 | 247 |
CCN(C(C)C)C(C)C.CCOC(C)=O.CN(C)C=O.COc1cc(OC)cc(C(=O)[C@H]2[C@H](C)[C@H](N)C[C@H]3C(C)(C)CCC[C@]23C)c1.Cc1ccccc1C(=O)O.F[P-](F)(F)(F)(F)F~c1ccc2c(c1)nnn2O[P+](N1CCCC1)(N1CCCC1)N1CCCC1>>COc1cc(OC)cc(C(=O)[C@H]2[C@H](C)[C@H](NC(=O)c3ccccc3C)C[C@H]3C(C)(C)CCC[C@]23C)c1 | 334 |
C1CCOC1.CCOC(=O)c1cnc2c(NC(=O)c3c(Cl)cccc3Cl)cccc2c1OCC.[BH4-]~[Li+].[Cl-]~[NH4+]>>CCOc1c(CO)cnc2c(NC(=O)c3c(Cl)cccc3Cl)cccc12 | 383 |
C1CCOC1.CCOC(C)=O.CN(C)C=O.COC(=O)CBr.Cc1cc(O)c2c3c(C(N)=O)cccc3n(Cc3ccccc3)c2c1.[H-].[Na+]>>COC(=O)COc1cc(C)cc2c1c1c(C(N)=O)cccc1n2Cc1ccccc1 | 557 |
Brc1ccccc1COCCC1CCNCC1.C=O.CC(=O)O[BH-](OC(C)=O)OC(C)=O~[Na+].CO>>CN1CCC(CCOCc2ccccc2Br)CC1 | 217 |
C1CCOC1.CCC(N)C1CCC(c2ccnc3ccc(F)cc23)CC1.CN(C)C(On1nnc2cccnc21)=[N+](C)C~F[P-](F)(F)(F)(F)F.CN(C)C=O.CN1CCOCC1.N#Cc1ccc(C(=O)O)cc1>>CCC(NC(=O)c1ccc(C#N)cc1)C1CCC(c2ccnc3ccc(F)cc23)CC1 | 334 |
CO.COC(=O)c1nc(-c2ccc(I)cc2)c(F)c(N)c1Cl.Cl.[Na+]~[OH-]>>Nc1c(F)c(-c2ccc(I)cc2)nc(C(=O)O)c1Cl | 152 |
CN(C)C1(c2ccccc2)CCC(CN)CC1.CO.COc1nc(OC)nc([N+]2(C)CCOCC2)n1.O=C(O)CCCCCc1c[nH]c2ccccc12.[Cl-]>>CN(C)C1(c2ccccc2)CCC(CNC(=O)CCCCCc2c[nH]c3ccccc23)CC1 | 230 |
C1CCOC1.CCO.CCOC(=O)c1cn(Cc2ccc(Oc3ccccc3)cc2)nc1OCc1nc(-c2ccccc2)oc1C.Cl.[Na+].[OH-]>>Cc1oc(-c2ccccc2)nc1COc1nn(Cc2ccc(Oc3ccccc3)cc2)cc1C(=O)O | 171 |
CC#N.CCN(C(C)C)C(C)C.CCN=C=NCCCN(C)C.CCNC(=O)Nc1ccc(-c2nc(N3CC4CCC(C3)O4)nc3c2C(=O)N(CCC(=O)O)CC(C)(C)O3)cc1.CNC.Cl.Cl.ClCCl.Oc1cccc2[nH]nnc12>>CCNC(=O)Nc1ccc(-c2nc(N3CC4CCC(C3)O4)nc3c2C(=O)N(CCC(=O)N(C)C)CC(C)(C)O3)cc1 | 146 |
CCO.ClCCl.O=C1CCc2cc(Br)ccc2C1.[BH4-].[Na+]>>OC1CCc2cc(Br)ccc2C1 | 91 |
CS(=O)(=O)c1ccc(OC2CCCC2)c(C(=O)O)c1.N#Cc1cnc(N2CCNCC2)s1>>CS(=O)(=O)c1ccc(OC2CCCC2)c(C(=O)N2CCN(c3ncc(C#N)s3)CC2)c1 | 44 |
CC(C)(C)OC(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)O.CCN=C=NCCCN(C)C~CI.CN(C)C=O.On1nnc2cccnc21.c1ccc(CN2CCNCC2)nc1>>CC(C)(C)OC(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N1CCN(Cc2ccccn2)CC1 | 146 |
Brc1ccc2cc(OCc3ccccc3)ccc2c1.C#CCCC.C#C[Si](C)(C)C>>CCCC#Cc1ccc2cc(OCc3ccccc3)ccc2c1 | 659 |
CCO.O=[N+]([O-])c1cccc(-c2ccccc2)c1>>Nc1cccc(-c2ccccc2)c1 | 1 |
CCN(CC)CC.CO.COC(=O)C1CCOCC1.ClCCl.Nc1c([N+](=O)[O-])c(OCc2ccccc2)nc2ccccc12.O=[N+]([O-])c1c(OCc2ccccc2)nc2ccccc2c1Cl.[NH4+]~[OH-]>>NC(=O)C1CCOCC1 | 432 |
CCOC(=O)Cc1cccc(Oc2ccc(C)cc2C=O)c1.CO.[BH4-]~[Na+]>>CCOC(=O)Cc1cccc(Oc2ccc(C)cc2CO)c1 | 356 |
CCN(CC)CC.CCOC(C)=O.CN(C)C=O.CN(C)[P+](On1nnc2ccccc21)(N(C)C)N(C)C.COCCN.COCCOc1cc2nccc(Oc3ccc(NC(=O)NC4CC4)c(Cl)c3)c2cc1C(=O)O.F[P-](F)(F)(F)(F)F.O>>COCCNC(=O)c1cc2c(Oc3ccc(NC(=O)NC4CC4)c(Cl)c3)ccnc2cc1OCCOC | 334 |
C1CCOC1.CCOC(=O)C(C)=Cc1ccc(C(C)C)cc1.O.[Al+3]~[H-]~[H-]~[H-]~[H-]~[Li+].[Ce+3]~[Cl-]~[Cl-]~[Cl-]>>CC(=Cc1ccc(C(C)C)cc1)CO | 150 |
COc1cc(N2CCN(C(=O)OC(C)(C)C)CC2)ccc1Nc1nc(Nc2c(F)ccc(Cl)c2Cl)cc2cn[nH]c(=O)c12.ClCCl.O=C(O)C(F)(F)F>>COc1cc(N2CCNCC2)ccc1Nc1nc(Nc2c(F)ccc(Cl)c2Cl)cc2cn[nH]c(=O)c12 | 575 |
COc1ccc(C2(O)CCC3(CC2)OCCO3)cn1.Cl.[Na+]~[OH-]>>COc1ccc(C2(O)CCC(=O)CC2)cn1 | 251 |
C1COCCO1.CC(C)Nc1cc(Cl)ncc1-c1nc(C(=O)N2CCCC(O)C2)cs1.CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.Nc1ccc2ncsc2c1.O.O=C(/C=C/c1ccccc1)/C=C/c1ccccc1.O=C(/C=C/c1ccccc1)/C=C/c1ccccc1.O=C(/C=C/c1ccccc1)/C=C/c1ccccc1.O=C([O-])[O-].[Na+].[Na+].[Pd].[Pd]>>CC(C)Nc1cc(Nc2ccc3ncsc3c2)ncc1-c1nc(C(=O)N2CCCC(O)C2)cs1 | 434 |
C(=NC1CCCCC1)=NC1CCCCC1.CCCCCCCC[C@H](C)C(=O)Oc1ccc(O)cc1.ClCCl.O=C(O)c1ccc(OCc2ccccc2)cc1>>CCCCCCCC[C@H](C)C(=O)Oc1ccc(OC(=O)c2ccc(OCc3ccccc3)cc2)cc1 | 355 |
CCCCOCCOc1ccc(-c2ccc3c(c2)C=C(C(=O)O)CCN3C(=O)C(F)(F)F)cc1.CCN(CC)CC.CCN=C=NCCCN(C)C~Cl.CN(C)C=O.CN(C)c1ccncc1.Cc1ccc(C(O)c2ccc(N)cc2)nc1.O.On1nnc2ccccc21>>CCCCOCCOc1ccc(-c2ccc3c(c2)C=C(C(=O)Nc2ccc(C(O)c4ccc(C)cn4)cc2)CCN3C(=O)C(F)(F)F)cc1 | 170 |
BrCCCCCCBr.O.OCCCCOc1ccccc1.[Na+].[OH-]>>BrCCCCCCOCCCCOc1ccccc1 | 95 |
CCO.CCOC(=O)CCN(C=O)CC(=O)OCC.O.[K+]~[OH-]>>CCOC(=O)CCN(C=O)CC(=O)O | 7 |
Cc1nc2c(Oc3ccc(N)c4ccccc34)ccnc2[nH]c1=O.O=C=Nc1cc(C(F)(F)F)ccc1F>>Cc1nc2c(Oc3ccc(NC(=O)Nc4cc(C(F)(F)F)ccc4F)c4ccccc34)ccnc2[nH]c1=O | 912 |
CCN(CC)CC.CN(C)C=O.CN~Cl.Cc1cc(-c2ccc(Cl)cc2F)c(C(=O)O)cn1.ClCCl.O.O=C(Cl)C(=O)Cl>>CNC(=O)c1cnc(C)cc1-c1ccc(Cl)cc1F | 674 |
CC(C)O.Cl.N#Cc1ccc(N)c([N+](=O)[O-])c1.O.[Br-].[Br-].[N-]=[N+]=[N-].[Na+].[Zn+2]>>Nc1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-] | 390 |
CC(=O)[O-]~[Na+].CCO.Cl~NO.O=Cc1cc(Cl)cc(Cl)c1>>ON=Cc1cc(Cl)cc(Cl)c1 | 30 |
CC(=O)O.CN(C)C=O.Cc1cc(C=O)cc(C)c1O.O=C1c2ccccc2C(=O)N1CCBr.[H-]~[Na+]>>Cc1cc(C=O)cc(C)c1OCCN1C(=O)c2ccccc2C1=O | 75 |
C1CCNC1.C1CCOC1.CCN(C(C)C)C(C)C.O=[N+]([O-])c1ccc(CBr)cc1F>>O=[N+]([O-])c1ccc(CN2CCCC2)cc1F | 248 |