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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o-nitrophenyl{p-[oxido(oxo)(1,3-thiazol-2-ylamino)-lambda-sulfaniumyl]phenylamino}(oxo)-lambda-sulfaniumolate CAS 296244-27-4 PubChem CID 1724694
O=[N+]([O-])c1ccccc1S(=O)(=O)Nc1ccc(S(=O)(=O)Nc2nccs2)cc1 -
(3Z)-5-bromo-3-(3-bromo-4,5-dihydroxybenzylidene)-1,3-dihydro-2H-indol-2-one CAS 486443-73-6 PubChem CID 1759437
O=C1Nc2ccc(Br)cc2/C1=C/c1cc(O)c(O)c(Br)c1 -
2-({5,6-diphenylfuro[2,3-d]pyrimidin-4-yl}(methyl)amino)ethan-1-ol CAS 859501-27-2 PubChem CID 4369432
CN(CCO)c1ncnc2oc(-c3ccccc3)c(-c3ccccc3)c12 -
O=S=O.Oc1ccc(O)cc1 -
tert-butyl N-[(3R,6S,9R,13Z)-3-[(1S,3R)-3-(butylcarbamoyl)-1-hydroxy-3-methylpropyl]-6-methyl-5,8-dioxo-1,11-dithia-4,7-diazacyclopentadec-13-en-9-yl]carbamate PubChem CID 11846473
CCCCNC(=O)[C@H](C)C[C@H](O)[C@@H]1CSC/C=C\CSC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H](C)C(=O)N1 -
4-((1R,5R)-4,4-dimethyl-8-methylene-3-oxabicyclo[3.3.1]nonan-2-yl)-N,N-dimethylaniline compound with N,N-dimethyl-4-((1R,5R)-4,4,8-trimethyl-3-oxabicyclo[3.3.1]non-7-en-2-yl)aniline (1:1) CAS 1212489-27-4 PubChem CID 16396849
C=C1CC[C@@H]2C[C@H]1C(c1ccc(N(C)C)cc1)OC2(C)C.CC1=CC[C@@H]2C[C@H]1C(c1ccc(N(C)C)cc1)OC2(C)C -
N-[3-(pyrrolidin-1-ylcarbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]thiophene-2-carboxamide PubChem CID 24901567
O=C(Nc1sc2c(c1C(=O)N1CCCC1)CCCC2)c1cccs1 -
(E)-3-(3-(2-(2,6,6-trimethylcyclohex-1- enyl)vinyl)phenyl)butan-1-amine PubChem CID 25101346
CC1=C(/C=C/c2cccc(C(C)CCN)c2)C(C)(C)CCC1 -
CCCCCCCC/C=C/C(=O)O.NCCO -
4-Methoxy-9-(2,3-dihydroxy-3-methylbutyl)-7H-furo[3,2-g][1]benzopyran-7-one CAS 64652-27-3 PubChem CID 45360314
COc1c2ccoc2c(CC(O)C(C)(C)O)c2oc(=O)ccc12 -
[2-[5-amino-1-(2-methyl-3H-benzimidazol-5-yl)pyrazole-4-carbonyl]-1H-indol-5-yl]-(3,3-difluoropiperidin-1-yl)methanone PubChem CID 50939620
Cc1nc2ccc(-n3ncc(C(=O)c4cc5cc(C(=O)N6CCCC(F)(F)C6)ccc5[nH]4)c3N)cc2[nH]1 -
(2S,5R)-5-(2-chlorophenyl)-1-(2,2-difluorobenzo[d][1,3]dioxole-6-carbonyl)pyrrolidine-2-carboxylic acid PubChem CID 53257448
O=C(O)[C@@H]1CC[C@H](c2ccccc2Cl)N1C(=O)c1ccc2c(c1)OC(F)(F)O2 -
1-{3-(5-chlorofuran-2-yl)-2-[2- (1H-imidazol-4-yl)ethyl]-1- oxo-1,2,3,4- tetrahydroisoquinolin-7-yl}-3- [4-(methylsulfanyl)phenyl]urea PubChem CID 60163088
CSc1ccc(NC(=O)Nc2ccc3c(c2)C(=O)N(CCc2cnc[nH]2)C(c2ccc(Cl)o2)C3)cc1 -
CN(C)C.O=C(O)c1ccccc1 -
4-[(S)-2-Azetidin-1-yl-1-(4-trifluoromethyl-phenyl)-ethylamino]-pyrido[3,2-d]pyrimidine-8-carboxylic acid amide PubChem CID 76073029
NC(=O)c1ccnc2c(N[C@H](CN3CCC3)c3ccc(C(F)(F)F)cc3)ncnc12 -
1-methyl-5-(2''-(pyrrolidin-1-ylmethyl)-[1,1''-biphenyl]-4-yl)-1H-benzo[d][1,2,3]triazole- 7-carboxylic acid; PubChem CID 85469020
Cn1nnc2cc(-c3ccc(-c4ccccc4CN4CCCC4)cc3)cc(C(=O)O)c21 -
(2S)-N-[(1S)-1-(2-chlorophenyl)-2-[(3,3-difluorocyclobutyl)amino]-2-oxoethyl]-N-(3-fluorophenyl)-1-(4-methylpyridin-2-yl)-5-oxopyrrolidine-2-carboxamide PubChem CID 89707845
Cc1ccnc(N2C(=O)CC[C@H]2C(=O)N(c2cccc(F)c2)[C@H](C(=O)NC2CC(F)(F)C2)c2ccccc2Cl)c1 -
8-(1-ethyl-5-methyl-1H-pyrazol- 4-yl)-9-methyl-6-({(3S)-1-[(2- methyl-1,3-oxazol-4- yl)carbonyl]pyrrolidin-3- yl}oxy)-9H-purine PubChem CID 90166434
CCn1ncc(-c2nc3c(O[C@H]4CCN(C(=O)c5coc(C)n5)C4)ncnc3n2C)c1C -
9-ethyl-6-({(3S)-1-[(3- fluoroazetidin-1- yl)carbonyl]pyrrolidin-3- yl}oxy)-8-(2-methylpyrimidin- 5-yl)-9H-purine PubChem CID 90166553
CCn1c(-c2cnc(C)nc2)nc2c(O[C@H]3CCN(C(=O)N4CC(F)C4)C3)ncnc21 -
N1-[(1S,2R)-1-benzyl-2-hydroxy-3-[isobutyl-(4-methoxyphenyl)sulfonyl-amino]propyl]-N2-[(2,5-dimethyloxazol-4-yl)methyl]-N2-methyl-phthalamide PubChem CID 90304955
COc1ccc(S(=O)(=O)N(CC(C)C)C[C@@H](O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2C(=O)N(C)Cc2nc(C)oc2C)cc1