Compound Search
化合物数据库
基于 PubChem CID 索引,支持名称 / 同义词 / CAS / SMILES 检索。
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US9522910, Table 1 Compound 4: 3-{2-[2-methyl-5-({4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl PubChem CID 90222283
Cc1ccc(C(=O)Nc2ccc(CN3CCN(C)CC3)c(C(F)(F)F)c2)cc1C#Cc1nnc2cc(C(N)=O)ccn12 -
4-AMINOBENZENESULFONIC ACID COMPOUND WITH 1-(4-CHLOROBENZYL)-4-OCTYL-1,4-DIHYDRO-5H-TETRAAZOL-5-IMINE PubChem CID 90486362
CCCCCCCCn1nnn(Cc2ccc(Cl)cc2)c1=N.Nc1ccc(S(=O)(=O)O)cc1 -
2-(4-benzyl-1-piperidinyl)-3-[(Z)-(3-methyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-4H-pyrido PubChem CID 90486385
CCO.CN1C(=O)/C(=C/c2c(N3CCC(Cc4ccccc4)CC3)nc3ccccn3c2=O)SC1=S -
3-((5Z)-5-{[2-(4-METHYL-1-PIPERIDINYL)-4-OXO-4H-PYRIDO[1,2-A]PYRIMIDIN-3-YL]METHYLENE}-4-OXO-2-THIOXO PubChem CID 90486386
CC1CCN(c2nc3ccccn3c(=O)c2/C=C2\SC(=S)N(CCC(=O)O)C2=O)CC1.CCO -
DIMETHYLFORMAMIDE COMPOUND WITH 3-[(Z)-(3-ISOBUTYL-4-OXO-2-THIOXO-1,3-THIAZOLIDIN-5-YLIDENE)METHYL]-9 PubChem CID 90486387
CN(C)C=O.Cc1ccc(CNc2nc3c(C)cccn3c(=O)c2/C=C2\SC(=S)N(CC(C)C)C2=O)cc1 -
DIMETHYLFORMAMIDE COMPOUND WITH 3-[(Z)-(3-ISOBUTYL-4-OXO-2-THIOXO-1,3-THIAZOLIDIN-5-YLIDENE)METHYL]-2 PubChem CID 90486388
CN(C)C=O.COc1ccc(CNc2nc3c(C)cccn3c(=O)c2/C=C2\SC(=S)N(CC(C)C)C2=O)cc1 -
2-(4-ETHYL-1-PIPERAZINYL)-3-{(Z)-[3-(2-FURYLMETHYL)-4-OXO-2-THIOXO-1,3-THIAZOLIDIN-5-YLIDENE]METHYL}- PubChem CID 90486565
CCN1CCN(c2nc3c(C)cccn3c(=O)c2/C=C2\SC(=S)N(Cc3ccco3)C2=O)CC1.CCO -
ETHYL [1-(3-{(E)-[3-(4-METHYLBENZYL)-4-OXO-2-THIOXO-1,3-THIAZOLIDIN-5-YLIDENE]METHYL}-4-OXO-4H-PYRIDO PubChem CID 90486577
CCOC(=O)CC1C(=O)NCCN1c1nc2ccccn2c(=O)c1/C=C1/SC(=S)N(Cc2ccc(C)cc2)C1=O.CN(C)C=O -
tricyclo[3.3.2.0~2,8~]deca-3,6,9-trien-3-ylmethyl 4-methoxybenzoate compound with tricyclo[3.3.2.0~2,8 PubChem CID 90487174
COc1ccc(C(=O)OCC2=CC3C4C=CC2C=CC43)cc1.COc1ccc(C(=O)OCC2=CC3C=CC4C(C=C3)C24)cc1 -
4-methyl-N'-(tricyclo[3.3.2.0~2,8~]deca-3,6,9-trien-3-ylmethylene)benzenesulfonohydrazide compound with PubChem CID 90487177
Cc1ccc(S(=O)(=O)NN=CC2=CC3C4C=CC2C=CC43)cc1.Cc1ccc(S(=O)(=O)NN=CC2=CC3C=CC4C(C=C3)C24)cc1 -
Chromate(1-), [3-[(4,5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)azo]-4-hydroxy-N-(1-methylethyl CAS 81361-04-8 PubChem CID 91809025
CC(C)N.CC(C)NS(=O)(=O)c1ccc(O)c(N=Nc2c(O)ccc3ccccc23)c1.Cc1nn(-c2ccccc2)c(=O)[c-]1N=Nc1cc(S(=O)(=O)NC(C)C)ccc1O.[Cr].[H+] -
4-[4-({[(1R)-1-(isoquinolin-8-yl)ethyl]amino}methyl)phenyl]-2-methoxybenzoic acid (Compound 4) PubChem CID 91970657
COc1cc(-c2ccc(CN[C@H](C)c3cccc4ccncc34)cc2)ccc1C(=O)O -
(2Z)-2-butenedioic acid compound with 2-[(4-{2-[4-(4-chlorobenzyl)-1-piperazinyl]ethoxy}phenyl)sulfanyl PubChem CID 117069399
O=C(O)/C=C\C(=O)O.O=C(O)c1ccccc1Sc1ccc(OCCN2CCN(Cc3ccc(Cl)cc3)CC2)cc1 -
(2Z)-2-butenedioic acid compound with 1-(4-{3-[4-(4-chlorobenzyl)-1-piperazinyl]propoxy}-2-hydroxy-3- PubChem CID 117069400
CCCc1c(OCCCN2CCN(Cc3ccc(Cl)cc3)CC2)ccc(C(C)=O)c1O.O=C(O)/C=C\C(=O)O.O=C(O)/C=C\C(=O)O -
(2Z)-2-butenedioic acid compound with 1-(4-chlorobenzyl)-4-[3-(4-methoxy-2-propylphenoxy)propyl]piperazine PubChem CID 117069402
CCCc1cc(OC)ccc1OCCCN1CCN(Cc2ccc(Cl)cc2)CC1.O=C(O)/C=C\C(=O)O.O=C(O)/C=C\C(=O)O -
(2Z)-2-butenedioic acid compound with {2-[(4-{3-[4-(4-chlorobenzyl)-1-piperazinyl]propoxy}phenyl)sulfanyl PubChem CID 117069403
O=C(O)/C=C\C(=O)O.O=C(O)/C=C\C(=O)O.O=C(O)Cc1ccccc1Sc1ccc(OCCCN2CCN(Cc3ccc(Cl)cc3)CC2)cc1 -
US9670203, Compound 1.86 1-(4-(4-methylpiperazin-1-yl)-3-(trifluoromethyl)phenyl)-3-((1S,1aS,6bS)-5-( PubChem CID 117807004
CN1CCN(c2ccc(NC(=O)N[C@@H]3[C@H]4Oc5ccc(Oc6ccnc7c6CCC(=O)N7)cc5[C@@H]34)cc2C(F)(F)F)CC1 -
US9670203, Compound 1.73 1-(4-((4-ethylpiperazin-1-yl)methyl)-3-(trifluoromethyl) phenyl)-3-((1S,1aS, PubChem CID 117807100
CCN1CCN(Cc2ccc(NC(=O)N[C@@H]3[C@H]4Oc5ccc(Oc6ccnc7c6CCC(=O)N7)cc5[C@@H]34)cc2C(F)(F)F)CC1 -
(2s)-2-ethoxy-n-methoxy-3-{4-[(4-methoxypyridin-2-yl)methoxy]phenyl}-n-methylpropanamide (compound no PubChem CID 117834093
CCO[C@@H](Cc1ccc(OCc2ccc(S(C)(=O)=O)cc2)cc1)C(=O)NOC -
4'-(5-Amino-1H-[1,2,4]triazol-3-ylamino)-6'-chloro-4-methoxy-2'-trifluoromethyl-biphenyl-3-sulfonic acid PubChem CID 118624862
COc1ccc(-c2c(Cl)cc(Nc3n[nH]c(N)n3)cc2C(F)(F)F)cc1S(=O)(=O)NC1CCNCC1.O=C(O)C(F)(F)F