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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2-amino-4-((5aS,6S,9R)-3-chloro-1-fluoro-5a,6,7,8,9,10-hexahydro-5H-6,9-epiminoazepino[2',1':3,4][1,4 PubChem CID 167294480
N#Cc1c(N)sc2c(F)ccc(-c3c(Cl)c4c5c(ncnc5c3F)N3C[C@H]5CC[C@H](N5)[C@H]3CO4)c12 -
4-((5aS,6S,9R)-3-chloro-1-fluoro-13-(((2R,7aS)-2-fluorohexahydro-1H-pyrrolizin-7a-yl)methoxy)-5a,6,7,8,9,10 PubChem CID 167294930
Nc1[nH]nc2sc3cccc(-c4c(Cl)c5c6c(nc(OC[C@@]78CCCN7C[C@H](F)C8)nc6c4F)N4C[C@H]6CC[C@H](N6)[C@H]4CO5)c3c12 -
(S)-7-[[6-O-(6-Deoxy-a-L-mannopyranosyl)-ss-D-glucopyranosyl]oxy]-2,3-dihydro-5-hydroxy-2-(3-hydroxy- CAS 11013-97-1 PubChem CID 5284419
COc1ccc([C@@H]2CC(=O)c3c(O)cc(O[C@@H]4O[C@H](CO[C@@H]5O[C@@H](C)[C@H](O)[C@@H](O)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)cc3O2)cc1OC -
(3-(4-Methoxy-phenyl)-3-{2-[4-(1-pyridin-2-ylmethyl-1H-benzoimidazole-2-carbonyl)-piperidin-1-yl]-ethyl PubChem CID 10190413
COc1ccc(C2(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccccn4)CC3)CCN(C(=O)c3cc(OC)c(OC)c(OC)c3)C2)cc1 -
14-(2-hydroxypentan-2-yl)-7-methoxy-3-methyl-1,2,3,4,7,7a-hexahydro-4a,7-ethano-4,12-methanobenzofuro CAS 39456-59-2 PubChem CID 23681189
O=P(O)(O)O.[F-].[Na+] -
Hydrogen bis(2-((5-(aminosulphonyl)-2-hydroxyphenyl)azo)-3-oxo-N-phenylbutyramidato(2-))cobaltate(1-) CAS 97338-24-4 PubChem CID 71300947
CC(=O)[C-](N=Nc1cc(S(N)(=O)=O)ccc1O)C(=O)Nc1ccccc1.CC(=O)[C-](N=Nc1cc(S(N)(=O)=O)ccc1O)C(=O)Nc1ccccc1.CCCCC(CC)COCCCN.[Co].[H+] -
2-Thiophenecarboxylic acid, 4-methyl-3-[[2-[(1-methylethyl)amino]-1-oxopropyl]amino]-, methyl ester; CAS 1796888-45-3 PubChem CID 121230774
COC(=O)c1scc(C)c1NC(=O)C(C)NC(C)C -
1-(2-{2-[3-(3H-Imidazol-4-yl)-2-(3-methyl-butyrylamino)-propionylamino]-propionylamino}-acetyl)-pyrrolidine PubChem CID 44387378
CCC(C)[C@H](NC(=O)[C@@H]1CCN(C(=O)CNC(=O)[C@H](C)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)CC(C)C)C1)C(=O)NCc1ccccc1 -
Butanedioic acid, 2,3-bis[(4-methylbenzoyl)oxy]-, (2S,3S)-, compd. with 4-[(1S)-4-(dimethylamino)-1-( CAS 128173-53-5 PubChem CID 74763977
CN(C)CCCC(O)(c1ccc(F)cc1)c1ccc(C#N)cc1CO.CN(C)CCCC(O)(c1ccc(F)cc1)c1ccc(C#N)cc1CO.Cc1ccc(C(=O)OC(C(=O)O)C(OC(=O)c2ccc(C)cc2)C(=O)O)cc1 -
1-((2R,3R)-2-(benzyloxy)pentan-3-yl)-4-(4-(4-(4-hydroxyphenyl)piperazin-1-yl)phenyl)-1H-1,2,4-triazol PubChem CID 118703662
CC[C@@H]([C@H](C)OCc1ccccc1)n1ncn(-c2ccc(N3CCN(c4ccc(O)cc4)CC3)cc2)c1=O.CC[C@H]([C@@H](C)OCc1ccccc1)n1ncn(-c2ccc(N3CCN(c4ccc(O)cc4)CC3)cc2)c1=O -
Preparation of (15S)-12,12,19-trimethyl-8-(3-{2-[1-(trifluoromethyl)cyclopropyl]ethoxy}-1H-pyrazol-1- PubChem CID 139399734
CN1CCC[C@@H]2CCC(C)(C)N2c2nc(-n3ccc(OCCC4(C(F)(F)F)CC4)n3)ccc2C(=O)NS(=O)(=O)c2cccc1n2 -
Preparation of (14R)-12,12-dimethyl-8-(3-{2-[1-(trifluoromethyl)cyclopropyl]ethoxy}-1H-pyrazol-1-yl)- PubChem CID 139399754
CC1(C)C[C@@H]2CCCNc3cccc(n3)S(=O)(=O)NC(=O)c3ccc(-n4ccc(OCCC5(C(F)(F)F)CC5)n4)nc3N1C2 -
Preparation of (15S)-12,12-dimethyl-8-(3-{2-[1-(trifluoromethyl) cyclopropyl]ethoxy}-1H-pyrazol-1-yl) PubChem CID 139400052
CC1(C)CC[C@H]2CCCNc3cccc(n3)S(=O)(=O)NC(=O)c3ccc(-n4ccc(OCCC5(C(F)(F)F)CC5)n4)nc3N21 -
(2R,4S,4'S,4''R,6S,6''S,9R,9aS,9''R,9a''S)-6,6''-di(furan-3-yl)-9,9''-dimethyltetradecahydro-2''H,3'H CAS 12698-70-3 PubChem CID 3084122
CC1CC[C@@H](c2ccoc2)N2CC3(CC[C@@H]12)CSC1(C[C@H](O)N2[C@H](c4ccoc4)CCC(C)[C@@H]2C1)C3.C[C@@H]1CC[C@@H](c2ccoc2)N2[C@@H](O)C[C@]3(C[C@@H]12)C[C@]1(CC[C@H]2[C@H](C)CC[C@@H](c4ccoc4)N2[C@@H]1O)CS3 -
(R)-2-(3-(8-amino-6-(4-methylpyridin-3-yl)isoquinolin-3-ylamino)-1H-pyrazol-1-yl)propanenitrile (Compound PubChem CID 135342328
Cc1ccncc1-c1cc(N)c2cnc(Nc3ccn([C@H](C)C#N)n3)cc2c1 -
(1S,2R,3R)N-(8-amino-7-fluoro-6-(4-methylpyridin-3-yl)isoquinolin-3-yl)-2-(cyanomethyl)-3-(1H-imidazol PubChem CID 135342558
Cc1ccncc1-c1cc2cc(NC(=O)[C@@H]3[C@@H](CC#N)[C@@H]3c3cnc[nH]3)ncc2c(N)c1F -
(+-)-N-(8-amino-6-(4-methylpyridin-3-yl)isoquinolin-3-yl)-2-(cyanomethyl)-3-methylcyclopropane-1-carboxamide PubChem CID 167844823
Cc1ccncc1-c1cc(N)c2cnc(NC(=O)[C@H]3[C@@H](C)[C@H]3CC#N)cc2c1 -
1-[[3-(2-Aminoethyl)-5-indolyl]methanesulfonyl]pyrrolidine; 1-[[[3-(2-Aminoethyl)-1H-indol-5-yl]methyl CAS 181178-24-5 PubChem CID 11197569
NCCc1c[nH]c2ccc(CS(=O)(=O)N3CCCC3)cc12 -
3-((2E)-2-(3-ethyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)-1,3-benzothiazol-3(2H)-yl)-1-propanesulfonic PubChem CID 14323590
CCN(CC)CC.CCN1C(=O)/C(=C2\Sc3ccccc3N2CCCS(=O)(=O)O)SC1=S -
(Z)-2-(4-oxo-5-((1-phenyl-3-(3-propoxyphenyl)-1H-pyrazol-4-yl)methylene)-2-thioxothiazolidin-3-yl)acetic CAS 1180026-73-6 PubChem CID 44660577
CC(=O)O.CCCOc1cccc(-c2nn(-c3ccccc3)cc2/C=C2\SC(=S)N(CC(=O)O)C2=O)c1