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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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(1R,2R)-N-(4-(2,6-dimethoxyphenyl)-5-(6-methoxypyridin-2-yl)-4H-1,2,4-triazol-3-yl)-1-(3-methoxyazetidin-1-yl)-1-(5-methylpyrimidin-2-yl)propane-2-sulfonamide PubChem CID 122701499
COc1cccc(-c2nnc(NS(=O)(=O)[C@@H](C)[C@H](c3ncc(C)cn3)N3CC(OC)C3)n2-c2c(OC)cccc2OC)n1 -
(1R,2S)-N-(4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-4H-1,2,4-triazol-3-yl)-1-(5-fluoro-2-pyrimidinyl)-1-methoxy-2-propanesulfonamide PubChem CID 122702002
COc1cccc(-c2nnc(NS(=O)(=O)[C@@H](C)[C@H](OC)c3ncc(F)cn3)n2-c2c(OC)cccc2OC)n1 -
3-fluoro-4-piperidin-4- ylsulfanylbenzenesulfonamide hydrochloride (intermediate 8)/ 3-[2-[(5-methyltetrazol-2- yl)methyl]-4-(trifluoromethyl)- phenyl]propanoic acid (CAS- RN 1646783-83-6) PubChem CID 135331087
Cc1nnn(Cc2cc(C(F)(F)F)ccc2CCC(=O)N2CCC(Sc3ccc(S(N)(=O)=O)cc3F)CC2)n1 -
(1S,2S)-2-(5-{(R)-4-[2,6-Dimethyl-4-(2-methyl-2H-tetrazol-5-yl)-phenyl]-indan-1-ylamino}-pyridin-2-yl)-cyclopropanecarboxylic acid PubChem CID 137529962
Cc1cc(-c2nnn(C)n2)cc(C)c1-c1ccc(F)c2c1CC[C@H]2Nc1ccc([C@H]2C[C@@H]2C(=O)O)nc1 -
(2S,3R)—N-(4-(2,6-dimethoxyphenyl)-5-(1-oxido-6-phenyl-2-pyridinyl)-4H-1,2,4-triazol-3-yl)-3-(5-fluoro-2-pyrimidinyl)-2-butanesulfonamide PubChem CID 140772556
COc1cccc(OC)c1N1/C(=N/S(=O)(=O)[C@@H](C)[C@H](C)c2ncc(F)cn2)N=N/C1=C1/C=CC=C(c2ccccc2)N1O -
(5RS)-5-{[(3S)-3-Fluoropyrrolidin-1-yl]carbonyl}-2-[4-fluoro-3-(trifluoromethyl)benzyl]-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one (Diastereomer Mixture; 2 Isomers) PubChem CID 142587520
O=C(C1CNCc2nn(Cc3ccc(F)c(C(F)(F)F)c3)c(=O)n21)N1CC[C@H](F)C1 -
(R)-N-(1-Acryloylpiperidin-3-yl)-5-(2-methyl-4-(pyridin-2- yloxy)phenyl)-4-oxo-4,5-dihydro-3H-1-thia-3,5,8- triazaacenaphthylene-2-carboxamide; PubChem CID 155921525
C=CC(=O)N1CCC[C@@H](NC(=O)C2=C3NC(=O)N(c4ccc(Oc5ccccn5)cc4C)C4CCNC(S2)C34)C1 -
(P1 and P2): N-(3,5-dichloro-4-((5-(1-hydroxyethyl)-6-oxo-1,6-dihydropyridazin-3-yl)oxy)phenyl)-5-oxo-4,5-dihydro-1,2,4-oxadiazole-3-carboxamide PubChem CID 155922429
CC(=O)c1cc(Oc2c(Cl)cc(NC(=O)C3NOC(=O)N3)cc2Cl)n[nH]c1=O -
N-(3,5-dichloro-4-((5-(1-hydroxypropyl)-6-oxo-1,6-dihydropyridazin-3-yl)oxy)phenyl)-5-oxo-4,5-dihydro-1,2,4-oxadiazole-3-carboxamide PubChem CID 155922432
CCC(=O)c1cc(Oc2c(Cl)cc(NC(=O)C3NOC(=O)N3)cc2Cl)n[nH]c1=O -
(+/−) 8-(4-((5-isopropoxypyridin-2-yl)oxy)-3,3-dimethylpiperidin-1-yl)-5-methyl-6-oxo-5,6-dihydro-1,5-naphthyridine-2-carbonitrile PubChem CID 156496304
CC(C)Oc1ccc(OC2CCN(c3cc(=O)n(C)c4ccc(C#N)nc34)CC2(C)C)nc1 -
A7-14 rac-2-((3R,4R)-4-(((6- (cyclopropyl((5- (trifluoromethyl)pyridin-2- yl)methyl)amino)-5- fluoropyrimidin-4- yl)amino)methyl)-3- hydroxypiperidin-1-yl)acetamide PubChem CID 156511714
NC(=O)CN1CC[C@@H](CNc2ncnc(N(Cc3ccc(C(F)(F)F)cn3)C3CC3)c2F)[C@H](O)C1 -
N-[6-(5-chloro-1,3-benzoxazol-2-yl)spiro[3.3]heptan-2-yl]-5-methylsulfonyl-furan-2-carboxamide PubChem CID 163379102
CS(=O)(=O)c1ccc(C(=O)NC2CC3(C2)CC(c2nc4cc(Cl)ccc4o2)C3)o1 -
4-(2-chloro-5- hydroxyphenyl)-7-(4- methyl-1,3-thiazol-5- yl)-2-(2-(2-propenoyl)- 2,6- diazaspiro[3.4]octan-6- yl)-5,6,7,8-tetrahydro- 1,7-naphthyridine-3- carbonitrile PubChem CID 167037152
C=CC(=O)N1CC2(CCN(c3nc4c(c(-c5cc(O)ccc5Cl)c3C#N)CCN(c3scnc3C)C4)C2)C1 -
1-((5S)-6-(7- fluoro-3-methyl- 4-(5-methyl-1H- indazol-4-yl)-2- quinolinyl)-5- methyl-2,6- diazaspiro[3.4] octan-2-yl)-2- propen-1-one PubChem CID 167037272
C=CC(=O)N1CC2(CCN(c3nc4cc(F)ccc4c(-c4c(C)ccc5[nH]ncc45)c3C)[C@H]2C)C1 -
4-{[6-(5-chloro-2-fluorophen- yl)-3-methylpyridazin-4-yl]- amino}quinolin-7-yl 5-methyl- 2,5-diazabicyclo[2.2.1]heptane- 2-carboxylate PubChem CID 168072225
Cc1nnc(-c2cc(Cl)ccc2F)cc1Nc1ccnc2cc(OC(=O)N3CC4CC3CN4C)ccc12 -
6-[(4R,5''S,7a''R)-3- methyl-3''-oxo-5''- phenyltetrahydro-1H,3''H- spiro[piperidine-4,2''- pyrrolo[2,1-b] [1,3]oxazol]-1- yl]pyrimidine-4- carbonitrile PubChem CID 168761564
CC1CN(c2cc(C#N)ncn2)CCC12O[C@@H]1CC[C@@H](c3ccccc3)N1C2=O -
6-chloro-N-[5-chloro-1-(1- methylcyclopropyl)-1H-pyrazol- 4-yl]-7-(5-methyl-2- azaspiro[3.3]heptan-2- yl)quinazolin-2-amine PubChem CID 169076049
CC1CCC12CN(c1cc3nc(Nc4cnn(C5(C)CC5)c4Cl)ncc3cc1Cl)C2 -
N-(6-chloro-5-{2-[(12S)-12-(2-fluoro-4-methylphenyl)-4-methyl-5-thia-2,3,7,11-tetraazatricyclo[6.4.0.0(2),?]dodeca-1(8),3,6-trien-11-yl]-2-oxoethoxy}pyridin-2-yl)methanesulfonamide CAS 1783256-96-1 PubChem CID 122531153
Cc1ccc([C@H]2c3c(nc4sc(C)nn34)CCN2C(=O)COc2ccc(NS(C)(=O)=O)nc2Cl)c(F)c1 -
Daridorexant; (S)-(2-(6-chloro-7-methyl-1H-benzo[d]imidazol-2-yl)-2-methylpyrrolidin-1-yl)(5-methoxy-2-(2H-1,2,3-triazol-2-yl)phenyl)methanone CAS 1505484-82-1 PubChem CID 91801202
COc1ccc(-n2nccn2)c(C(=O)N2CCC[C@@]2(C)c2nc3c(C)c(Cl)ccc3[nH]2)c1 -
(S)-(6-(6-(6-(1-aminobutyl)pyrazin-2-yl)-1H-indazol-1-yl)pyridin-2-yl)methanol CAS 23229-25-6 PubChem CID 20361700
Brc1cncc(Br)n1