Compound Search
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基于 PubChem CID 索引,支持名称 / 同义词 / CAS / SMILES 检索。
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3-(2-{[(2-oxo-1,2-dihydropyridin-3-yl)carbonyl]amino}-1,3-thiazol-4-yl)propanoic acid CAS 1105192-05-9 PubChem CID 33679330
O=C(O)CCc1csc(NC(=O)c2ccc[nH]c2=O)n1 -
(2S)-N-[(1S)-1-{[(1R)-1-{[(2S)-1-[(2R)-2-[(2S)-2-{[(1S)-1-CARBAMOYLPENTYL]CARBAMOYL}PYRROLIDINE-1-CARBONYL]PYRROLIDIN-1-YL]-1-OXO-3-PHENYLPROPAN-2-YL]CARBAMOYL}-2-(1H-INDOL-3-YL)ETHYL]CARBAMOYL}ETHYL]-6-[(7-NITRO-2,1,3-BENZOXADIAZOL-4-YL)AMINO]-2-(PHENYLFORMAMIDO)HEXANAMIDE CAS 157610-41-8 PubChem CID 190883
CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)NC(=O)[C@H](CCCCNc1ccc([N+](=O)[O-])c2nonc12)NC(=O)c1ccccc1)C(N)=O -
2-[3-cyano-4-(4-fluorophenyl)-5,5-dimethyl-2,5-dihydrofuran-2-ylidene]propanedinitrile CAS 425604-51-9 PubChem CID 53415751
CC1(C)OC(=C(C#N)C#N)C(C#N)=C1c1ccc(F)cc1 -
CCC(Cc1ccccc1)c1cc(O)c(C(c2cccc(NC(=O)[C@H](Cc3cn(S(=O)(=O)c4ccc(C)cc4)cn3)NC(=O)OC(C)(C)C)c2)C2CC2)c(=O)o1 -
N-[(2R)-1-[[(2S)-3-(1H-indol-3-yl)-1-[[(2S)-1-[(2R)-2-methyloxiran-2-yl]-1-oxo-3-phenylpropan-2-yl]amino]-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]-3-methyl-1H-indene-2-carboxamide CAS 1416709-79-9 PubChem CID 92135659
CC1=C(C(=O)N[C@H](C)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](Cc2ccccc2)C(=O)[C@@]2(C)CO2)Cc2ccccc21 -
Nc1nc(N)nc(N)n1 -
{[(2R,3R,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-{[(2S,3R,4S,5R)-3,4-dihydroxy-5-[(phosphonooxy)methyl]oxolan-2-yl]oxy}-3-hydroxyoxolan-2-yl]methoxy}phosphonic acid CAS 15720-01-1 PubChem CID 3080702
Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]1O[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]1O -
CC1=C[C@H]2Cc3[nH]c(=O)ccc3[C@]3(C1)NCCC[C@H]23 -
(2E)-2-(1H-benzimidazol-2-yl)-3-{5-[2-chloro-5-(trifluoromethyl)phenyl]furan-2-yl}prop-2-enenitrile PubChem CID 5827927
N#C/C(=C\c1ccc(-c2cc(C(F)(F)F)ccc2Cl)o1)c1nc2ccccc2[nH]1 -
(2E)-3-[5-(2-chloro-4-nitrophenyl)furan-2-yl]-1-[5-(2-chlorophenyl)furan-2-yl]prop-2-en-1-one PubChem CID 6077603
O=C(/C=C/c1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)c1ccc(-c2ccccc2Cl)o1 -
2-(4-nitrophenyl)-2-oxoethyl (2Z)-3-(4-chlorophenyl)-2-[(phenylcarbonyl)amino]prop-2-enoate CAS 1164478-67-4 PubChem CID 6509469
O=C(OCC(=O)c1ccc([N+](=O)[O-])cc1)/C(=C/c1ccc(Cl)cc1)NC(=O)c1ccccc1 -
(S,E)-2-(4-(2,4-Dichlorophenyl)-1,3-dithiolan-2-ylidene)-2-(1H-imidazol-1-yl)acetonitrile CAS 187164-19-8 PubChem CID 53394969
N#CC(=C1SCC(c2ccc(Cl)cc2Cl)S1)n1ccnc1 -
(6E)-6-[[[3-(2-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]amino]methylidene]-2-prop-2-enylcyclohexa-2,4-dien-1-one CAS 489404-28-6 PubChem CID 135495519
C=CCc1cccc(/C=N/n2c(-c3ccccc3C)n[nH]c2=S)c1O -
(2E)-2-cyano-N-(furan-2-ylmethyl)-3-{1-[2-(morpholin-4-yl)-2-oxoethyl]-1H-indol-3-yl}prop-2-enamide CAS 347327-08-6 PubChem CID 1275856
N#C/C(=C\c1cn(CC(=O)N2CCOCC2)c2ccccc12)C(=O)NCc1ccco1 -
5-(2-fluorophenyl)-4-({(E)-[2-hydroxy-3-(prop-2-en-1-yl)phenyl]methylidene}amino)-2,4-dihydro-3H-1,2,4-triazole-3-thione CAS 578006-04-9 PubChem CID 135630658
C=CCc1cccc(/C=N/n2c(-c3ccccc3F)n[nH]c2=S)c1O -
N-tert-Butyl-2-{3-[[2-[(2,2-dimethylpropionyl)amino]phenyl]sulfanyl]-2-hydroxypropyl}benzamide, (R,S)- PubChem CID 460995
CC(C)(C)NC(=O)c1ccccc1CC(O)CSc1ccccc1NC(=O)C(C)(C)C -
tert-Butyl-2-{3-[[2-[(tert-Butylcarbamoyl)phenyl]sulfanyl]-2-hydroxypropyl}benzamide, (R,S)- PubChem CID 460996
CC(C)(C)NC(=O)c1ccccc1CC(O)CSc1ccccc1C(=O)NC(C)(C)C -
2-AMINO-6-(1,1-DIMETHYL-PROPYL)-4,5,6,7-TETRAHYDRO-BENZO[ B ]THIOPHENE-3-CARBONITRILE CAS 329222-98-2 PubChem CID 591807
CCC(C)(C)C1CCc2c(sc(N)c2C#N)C1 -
2-[(4-hydroxy-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]-N-(prop-2-en-1-yl)acetamide CAS 325476-27-5 PubChem CID 1734907
C=CCNC(=O)CSc1nc2sc3c(c2c(=O)[nH]1)CCCC3 -
(5E)-3-(3-methoxypropyl)-5-[[5-(2-nitrophenyl)furan-2-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one CAS 851305-19-6 PubChem CID 1959801
COCCCN1C(=O)/C(=C\c2ccc(-c3ccccc3[N+](=O)[O-])o2)SC1=S