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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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CCC1(O)COCCN(c2nc(OC[C@@]34CCCN3C[C@H](F)C4)nc3c(F)c(-c4ccc(F)c5sc(N)c(C#N)c45)c(Cl)cc23)C1 -
3-{3-(4-fluorophenyl)-4-[6-(3- methylpyridin-2-yl)furo[2,3- d]pyrimidin-4-yl]-1H-pyrazol-1- yl}-126-thietane-1,1-dione PubChem CID 170171875
Cc1ccccc1-c1cc2c(-c3cn(C4CS(=O)(=O)C4)nc3-c3ccc(F)cc3)ncnc2o1 -
4-(3-(4-fluorophenyl)-1- ((2S,3R)-2- methyltetrahydrofuran-3-yl)-1H- pyrazol-4-yl)-6-phenylfuro[2,3- d]pyrimidine (absolute stereochemistry arbitrarily assigned) PubChem CID 170274414
C[C@@H]1OCC[C@H]1n1cc(-c2ncnc3oc(-c4ccccc4)cc23)c(-c2ccc(F)cc2)n1 -
(2R,3R,4S,5R,6R)-2-(hydroxymethyl)-5-methoxy-6-(((R)-3-(piperidin-4-yl)-4,5-dihydroisoxazol-5-yl)methyl)-4-(4-(3,4,5-trifluorophenyl)-1H-1,2,3-triazol-1-yl)tetrahydro-2H-pyran-3-ol PubChem CID 170691968
CO[C@@H]1[C@@H](n2cc(-c3cc(F)c(F)c(F)c3)nn2)[C@@H](O)[C@@H](CO)O[C@@H]1C[C@H]1CC(C2CCNCC2)=NO1 -
(3R)-3-amino-5-[(4- chlorophenyl)methyl]-8- fluoro-7-[5-(4-oxa-7- azaspiro[2.5]octan-7-yl)-1,2,4- oxadiazol-3-yl]-1-oxo-2,3- dihydro-1lambda4,5-benzothiazepin- 4-one (Epimer A) (*) PubChem CID 171573553
N[C@H]1CS(=O)c2cc(F)c(-c3noc(N4CCOC5(CC5)C4)n3)cc2N(Cc2ccc(Cl)cc2)C1=O -
(3R)-3-amino-5-[(4- chlorophenyl)methyl]-8- fluoro-1-oxo-7-[5-[2- (trifluoromethyl)morpholin-4- yl]-1,2,4-oxadiazol-3-yl]-2,3- dihydro-1lambda4,5-benzothiazepin- 4-one (Epimer A) (*) PubChem CID 171573574
N[C@H]1CS(=O)c2cc(F)c(-c3noc(N4CCOC(C(F)(F)F)C4)n3)cc2N(Cc2ccc(Cl)cc2)C1=O -
Preparation of (E)-2,4-difluoro-N-(5-(4-(4-(4-oxopent-2-enoyl)piperazin-1-yl)quinazolin-6-yl)-2-(trifluoromethoxy)pyridin-3-yl)benzenesulfonamide PubChem CID 176733108
CC(=O)/C=C/C(=O)N1CCN(c2ncnc3ccc(C4=CNC(OC(F)(F)F)C(NS(=O)(=O)c5ccc(F)cc5F)=C4)cc23)CC1 -
5-Furan-2-yl-1-((2S,4S,5R)-4-hydroxy-5-hydroxymethyl-tetrahydro-furan-2-yl)-1H-pyrimidine-2,4-dione CAS 1272353-73-7 PubChem CID 51030636
c1ccc(-c2cccc3nc(-c4cncnc4)nc(NCc4ccccn4)c23)cc1 -
cis-{1-{3-Methoxy-1-[3-fluoro-2-(trifluoromethyl)isonicotinoyl]piperidin-4-yl}-3-[4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)-1H-pyrazol-1-yl]azetidin-3-yl}acetonitrile PubChem CID 58431349
CO[C@@H]1CN(C(=O)c2ccnc(C(F)(F)F)n2)CC[C@@H]1N1CC(CC#N)(n2cc(-c3ncnc4[nH]ccc34)cn2)C1 -
Diastereomers of {1-[1-(3-fluorobenzoyl)-2-methylpiperidin-4-yl]-3-[4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)-1H-pyrazol-1-yl]azetidin-3-yl}acetonitrile PubChem CID 58431373
CC1CC(N2CC(CC#N)(n3cc(-c4ncnc5[nH]ccc45)cn3)C2)CCN1C(=O)c1cccc(F)c1 -
Diastereomers of 3-[(4-{3-(cyanomethyl)-3-[4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)-1H-pyrazol-1-yl]azetidin-1-yl}-2-methylpiperidin-1-yl)methyl]-6-(dimethylamino)-2-fluorobenzonitrile PubChem CID 58431380
CC1CC(N2CC(CC#N)(n3cc(-c4ncnc5[nH]ccc45)cn3)C2)CCN1Cc1ccc(N(C)C)c(C#N)c1F -
Distereomers of {1-[1-(2-chloro-6-fluorobenzyl)-2-methylpiperidin-4-yl]-3-[4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)-1H-pyrazol-1-yl]azetidin-3-yl}acetonitrile PubChem CID 58431410
CC1CC(N2CC(CC#N)(n3cc(-c4ncnc5[nH]ccc45)cn3)C2)CCN1Cc1c(F)cccc1Cl -
N-{4-(2,4-difluorophenoxy)-3-[1-(2H3)methyl- 6-oxopyridin-3-yl]phenyl}ethanesulfonamide PubChem CID 72549437
CCS(=O)(=O)Nc1ccc(Oc2ccc(F)cc2F)c(-c2ccc(=O)n(C)c2)c1 -
1-[4-(4-methyl-pyrazol-1-ylmethyl)-benzyl]-1H-imidazole-4-carboxylic acid (1-amino-isoquinolin-6-ylmethyl)-amide PubChem CID 86344559
Cc1cnn(Cc2ccc(Cn3cnc(C(=O)NCc4ccc5c(N)nccc5c4)c3)cc2)c1 -
rac-(E)-3-(4-Chloro-2-((5-methyl-2H-tetrazol-2-yl)methyl)phenyl)-1-(4-((4-chlorophenyl)(hydroxy)methyl)piperidin-1-yl)prop-2-en-1-one PubChem CID 90646384
Cc1nnn(Cc2cc(Cl)ccc2/C=C/C(=O)N2CCC(C(O)c3ccc(Cl)cc3)CC2)n1 -
(1S)-2-acetyl-1-(3''''-fluoro-3-methoxy-4-biphenylyl)-N-3-isoxazolyl-1,2,3,4-tetrahydro-6-isoquinolinesulfonamide PubChem CID 117741661
COc1cc(-c2cccc(F)c2)ccc1C1c2ccc(S(=O)(=O)Oc3c(F)c(F)c(F)c(F)c3F)cc2CCN1C(C)=O -
COc1cc(C(=O)NS(C)(=O)=O)c(F)cc1-c1cnc(O[C@H](C)C2CCC2)c(Cl)c1 -
[3-(4-{[(1R,2S)-2-(4-fluorophenyl)cyclopropyl]amino}piperidin-1-yl)-1-(4-hydroxycyclohexyl)azetidin-3-yl]acetonitrile (Isomer 1) PubChem CID 118297911
N#CCC1(N2CCC(N[C@@H]3CC3c3ccc(F)cc3)CC2)CN(C2CCC(O)CC2)C1 -
4-(4-((2-(4-(1-cyanocyclopropyl)phenyl)cyclohept-1-en-1-yl)methoxy)phenyl) butanoic Acid PubChem CID 118679785
N#CC1(c2ccc(C3=C(COc4ccc(CCCC(=O)O)cc4)CCCCC3)cc2)CC1 -
N-Cyclopropyl-3-(2-methoxypyrimidin-5-yl)imidazo[1,2-b]pyridazine-2-carboxamide (4) CAS 1873385-88-6 PubChem CID 118863061
CCOC(=O)c1nc2cccnn2c1I