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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5-[4-amino-5-(trifluoromethyl)- pyrrolo[2,1-f][1,2,4]triazin-7- yl]-N-[(3R,4S)-4-fluoro-1-(3- hydroxy-3-methylbutan-2-yl)- pyrrolidin-3-yl]-2-methoxy- pyridine-3-carboxamide PubChem CID 155252522
COc1ncc(-c2cc(C(F)(F)F)c3c(N)ncnn23)cc1C(=O)N[C@@H]1CN(C(C)C(C)(C)O)C[C@@H]1F -
(S)-N-(3-(2-(((1R,3S)-3-hydroxy-3- methylcyclobutyl)amino)-6- morpholinopyridin-4-yl)-4- methylphenyl)-3-(2,2,2- trifluoroethyl)pyrrolidine-1-carboxamide PubChem CID 156297388
Cc1ccc(NC(=O)N2CC[C@@H](CC(F)(F)F)C2)cc1-c1cc(NC2CC(C)(O)C2)nc(N2CCOCC2)c1 -
(5''S,7a''R)-1-(3- fluoropyrazolo[1,5-a] pyrimidin-7-yl)-5''-(5- fluoropyridin-3- yl)tetrahydro-3''H- spiro[piperidine-4,2''- pyrrolo[2,1-b]oxazol]-3''- one, TFA salt PubChem CID 168244929
O=C1N2[C@@H](CC[C@H]2c2cncc(F)c2)OC12CCN(c1ccnc3c(F)cnn13)CC2 -
(3[S or R], 4 [R or S], 5''S,7a''R)-1- ([1,2,4]triazolo[1,5- a]pyridin-5-yl)-3- fluoro-5''- phenyltetrahydro-3''H- spiro[piperidine-4,2''- pyrrolo[2,1-b]oxazol]- 3''-one, TFA salt PubChem CID 168245459
O=C1N2[C@@H](CC[C@H]2c2ccccc2)OC12CCN(c1cccc3ncnn13)CC2F -
(3[R or S],4[S or R], 5''S,7a''R)-3-fluoro-5''- phenyl-1-(pyrazolo [1,5-a][1,3,5]triazin-4- yl)tetrahydro-3''H- spiro[piperidine-4,2''- pyrrolo[2,1-b]oxazol]-3''- one PubChem CID 168245595
O=C1N2[C@@H](CC[C@H]2c2ccccc2)OC12CCN(c1ncnc3ccnn13)CC2F -
(3[R or S],4[S or R], 5''S,7a''R)-1-benzoyl-3- fluoro-5''-phenyltetrahydro- 3''H-spiro[piperidine-4,2''- pyrrolo[2,1-b]oxazol]-3''- one PubChem CID 168245645
O=C(c1ccccc1)N1CCC2(O[C@@H]3CC[C@@H](c4ccccc4)N3C2=O)C(F)C1 -
6-((3[R or S],4[S or R], 5''S,7a''R)-3-fluoro-3''- oxo-5''-phenyltetrahydro- 3''H-spiro[piperidine-4,2''- pyrrolo[2,1-b]oxazol]-1- yl)pyrimidine-4- carbonitrile PubChem CID 168245773
N#Cc1cc(N2CCC3(O[C@@H]4CC[C@@H](c5ccccc5)N4C3=O)C(F)C2)ncn1 -
CC(C)(C)[C@H](c1cc(-c2cc(F)ccc2F)cn1Cc1ccccc1)N(CC[C@H](N)C(=O)NCCNC(=O)CNC(=O)CC(SC[C@H](N)C(=O)O)C(=O)O)C(=O)CO -
1-Ethyl-7-[[(1S)-1-[4-[3- methyl-1-(4-prop-2- enoylpiperazin-1- yl)butyl]phenyl]ethyl]amino]- 4H-pyrimido[4,5- d][1,3]oxazin-2-one PubChem CID 135142549
C=CC(=O)N1CCN(C(CC(C)C)c2ccc([C@H](C)Nc3ncc4c(n3)N(CC)C(=O)OC4)cc2)CC1 -
[(1S)-2-(3,5-dichloro-1-oxido-pyridin-1-ium-4-yl)-1-(3,4-dimethoxyphenyl)ethyl]5-[[[2-oxo-1-phenyl-2-[[(3S)-quinuclidin-3-yl]methoxy]ethyl]amino]methyl]thiophene-2-carboxylate PubChem CID 138403940
COc1ccc([C@H](Cc2c(Cl)c[n+]([O-])cc2Cl)OC(=O)c2ccc(CNC(C(=O)OC[C@@H]3CN4CCC3CC4)c3ccccc3)s2)cc1OC -
[(1S)-2-(3,5-dichloro-1-oxido-pyridin-1-ium-4-yl)-1-(3,4-dimethoxyphenyl)ethyl]5-[[[2-oxo-1-phenyl-2-[[(3R)-quinuclidin-3-yl]methoxy]ethyl]amino]methyl]thiophene-2-carboxylate PubChem CID 138403941
COc1ccc([C@H](Cc2c(Cl)c[n+]([O-])cc2Cl)OC(=O)c2ccc(CNC(C(=O)OC[C@H]3CN4CCC3CC4)c3ccccc3)s2)cc1OC -
1-[(3S,4R)-3-[[2-[(1-Ethyl-1H-pyrazol-4-yl)amino]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]oxy]-4-fluoro-1-piperidinyl]-2-propen-1-one CAS 2360992-48-7 PubChem CID 142755106
C=CC(=O)N1CC[C@@H](F)[C@@H](Oc2nc(Nc3cnn(CC)c3)nc3[nH]ccc23)C1 -
2-(4-(2-(4-cyano- 2- fluorophenyl)benzo [d][1,3]dioxol-4- yl)-2- fluorobenzyl)-1- (2-methoxyethyl)- 1H- benzo[d]imidazole- 6-carboxylic acid PubChem CID 156813663
COCCn1c(Cc2ccc(-c3cccc4c3OC(c3ccc(C#N)cc3F)O4)cc2F)nc2ccc(C(=O)O)cc21 -
(1r,1'aR*,4r,6'aS*)-4-(3-chloroanilino)-1'a,6'a-dihydro-1'H-spiro[cyclohexane-1,6'-cyclopropa[a]indene]-4-carboxylic acid, enantiomer 2 PubChem CID 164582146
O=C(O)C1(Nc2cccc(Cl)c2)CCC2(CC1)c1ccccc1[C@@H]1C[C@@H]12 -
1-{1-[1-(2-Fluorophenyl)-1H-1,2,3-triazol-4-yl]propyl}-3-[2-(trifluoromethyl)pyrimidin-5-yl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine, enantiomer 1 and 2 PubChem CID 134608180
CCC(c1cn(-c2ccccc2F)nn1)n1nc(-c2cnc(C(F)(F)F)nc2)c2c(N)ncnc21 -
2-(3-fluoro-2-methoxypyridin-4-yl)-1-[(2S)-7-methyl-6-(pyrimidin-2-yl)-3,4-dihydro-1H-spiro[1,8-naphthyridine-2,3''-pyrrolidin]-1''-yl]propan-1-one, DIAST-1 PubChem CID 166585262
COc1nccc([C@@H](C)C(=O)N2CC[C@@]3(CCc4cc(-c5ncccn5)c(C)nc4N3)C2)c1F -
2-(3-fluoro-4-methoxyphenyl)-1-[(2S)-7-methyl-6-(pyrimidin-2-yl)-3,4-dihydro-1H-spiro[1,8-naphthyridine-2,3''-pyrrolidin]-1''-yl]propan-1-one, DIAST-1 PubChem CID 166585267
COc1ccc([C@@H](C)C(=O)N2CC[C@@]3(CCc4cc(-c5ncccn5)c(C)nc4N3)C2)cc1F -
2-[6-(difluoromethoxy)pyridin-3-yl]-1-[(2S)-7-methyl-6-(2-methyl-2H-tetrazol-5-yl)-3,4-dihydro-1H-spiro[1,8-naphthyridine-2,3''-pyrrolidin]-1''-yl]propan-1-one, DIAST-1 PubChem CID 166585531
Cc1nc2c(cc1-c1nnn(C)n1)CC[C@@]1(CCN(C(=O)[C@H](C)c3ccc(OC(F)F)nc3)C1)N2 -
2-[3-(difluoromethoxy)-5-methoxyphenyl]-1-[(2S)-7-methyl-6-(pyrimidin-2-yl)-3,4-dihydro-1H-spiro[1,8-naphthyridine-2,3''-pyrrolidin]-1''-yl]propan-1-one, partial formate salt, DIAST-1 PubChem CID 166585569
COc1cc(OC(F)F)cc([C@@H](C)C(=O)N2CC[C@@]3(CCc4cc(-c5ncccn5)c(C)nc4N3)C2)c1 -
COc1ccc(Cl)cc1S(=O)(=O)Nc1cccnc1