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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NC(=S)SSC(N)=S -
4H-1-Benzopyran-4-one, 5,7-dihydroxy-8-[5-(5-hydroxy-7-methoxy-4-oxo-4H-1-benzopyran-2-yl)-2-methoxyphenyl]-2-(4-methoxyphenyl)- CAS 521-34-6 PubChem CID 5281696
COc1ccc(-c2cc(=O)c3c(O)cc(O)c(-c4cc(-c5cc(=O)c6c(O)cc(OC)cc6o5)ccc4OC)c3o2)cc1 -
GlyTouCan:G63900IJ PubChem CID 9855414
CCCCCCCCCCCCCC(=O)OC(CCCCCCCCCCC)CC(=O)O[C@@H]1[C@@H](NC(=O)CC(CCCCCCCCCCC)OC(=O)CCCCCCCCCCC)[C@H](OC[C@H]2O[C@H](O)[C@H](NC(=O)CC(O)CCCCCCCCCCC)[C@@H](OC(=O)CC(O)CCCCCCCCCCC)[C@@H]2O)O[C@H](CO)[C@H]1OP(=O)(O)O -
(R)-5-((S)-1,2-dihydroxyethyl)-3,4-dihydroxyfuran-2(5H)-one compound with 1-(4-phenethylpiperazin-1-yl)-2-(1-phenylcyclohexyl)ethanone (1:1) CAS 36431-82-0 PubChem CID 54676865
O=C(CC1(c2ccccc2)CCCCC1)N1CCN(CCc2ccccc2)CC1.O=C1O[C@H]([C@@H](O)CO)C(O)=C1O -
3-[2-[1-[(2-Fluorophenyl)methyl]-5-(1,2-oxazol-3-yl)pyrazol-3-yl]pyrimidin-4-yl]-4-(trifluoromethyl)-1,3-oxazolidin-2-one PubChem CID 90445866
O=C1OCC(C(F)(F)F)N1c1ccnc(-c2cc(-c3ccon3)n(Cc3ccccc3F)n2)n1 -
2-(5- (cyclopropylmethyl)- 3-(3- isopropoxyphenyl)-4- (4-sulfamoylbenzyl)- 1H-pyrazol-1- yl)thiazole-4- carboxylic acid; MS (ES) 552.6 (M + H)+; LCMS RT = 0.98 min. PubChem CID 121457594
CC(C)Oc1cccc(-c2nn(-c3nc(C(=O)O)cs3)c(CC3CC3)c2Cc2ccc(S(N)(=O)=O)cc2)c1 -
(S)-8-chloro-6-(((1-cyclopropyl-1H-1,2,3- triazol-4-yl)(isoquinolin-8-yl)methyl)amino)- 4-(neopentylamino)quinoline-3-carbonitrile PubChem CID 124181299
CC(C)(C)CNc1c(C#N)cnc2c(Cl)cc(N[C@H](C3=CN(C4CC4)NN3)c3cccc4ccncc34)cc12 -
(5R)-3-[3-fluoro-4-(3-thia-8-azabicyclo[3.2.1]octan-8-yl)phenyl]-5-(triazol-1-ylmethyl)oxazolidin-2-one PubChem CID 126496058
O=C1O[C@@H](Cn2ccnn2)CN1c1ccc(N2C3CCC2CSC3)c(F)c1 -
(2S,4R)-1-(2-(3- acetyl-5- (quinazolin-6-yl)- 1H-indazol-1- yl)acetyl)-N-(6- bromopyridin-2- yl)-4- fluoropyrrolidine- 2-carboxamide PubChem CID 126642864
CC(=O)c1nn(CC(=O)N2C[C@H](F)C[C@H]2C(=O)Nc2cccc(Br)n2)c2ccc(-c3ccc4ncncc4c3)cc12 -
2-[(9S)-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaen-9-yl]-N-(2,2-difluoroethyl)acetamide PubChem CID 126693092
Cc1sc2c(c1C)C(c1ccc(Cl)cc1)=N[C@@H](CC(=O)NCC(F)F)c1nnc(C)n1-2 -
5-cyclopropyl-N-((2R,4S)-1-((6-((2- methoxyethyl)(methyl)amino)pyridin-3- yl)sulfonyl)-2-methylpiperidin-4- yl)isoxazole-3-carboxamide PubChem CID 132242739
COCCN(C)c1ccc(S(=O)(=O)N2CC[C@H](NC(=O)c3cc(C4CC4)on3)C[C@H]2C)cn1 -
3-((S)-3-((R)-8-(2,3-dihydrofuro[2,3-b]pyridin-5-ylsulfonyl)-1-oxa-8-azaspiro[4.5]decan-3-ylamino)-2-hydroxypropoxy)-N-methylbenzenesulfonamide PubChem CID 138681203
CNS(=O)(=O)c1cccc(OC[C@@H](O)CN[C@H]2COC3(CCN(S(=O)(=O)c4cnc5c(c4)CCO5)CC3)C2)c1 -
3-[4-[(3R)-4-(2-oxaspiro[3.3]heptan-6-yl)-3-(1H-pyrazol-4-yl)piperazin-1-yl]pyrimidin-2-yl]-6-(trifluoromethyl)imidazo[1,2-a]pyridine PubChem CID 139344434
FC(F)(F)c1ccc2ncc(-c3nccc(N4CCN(C5CC6(COC6)C5)[C@H](c5cn[nH]c5)C4)n3)n2c1 -
ethyl 2-(3-((R)-1-(2-methyl-2H- tetrazole-5-carboxamido)-2,3- dihydro-1H-inden-5-yl)-1,2,4- oxadiazol-5-yl)propanoate PubChem CID 139412939
CCOC(=O)C(C)c1nc(-c2ccc3c(c2)CC[C@H]3NC(=O)c2nnn(C)n2)no1 -
6-(3-cyanopyrrolo[1,2- b]pyridazin-7-yl)-N-((R)- 2-fluoro-3-hydroxy-3-methyl butyl)-4-(((1S,3S,4S)-3- hydroxybicyclo[2.2.1] heptan-1-yl)amino) nicotinamide PubChem CID 140896645
CC(C)(O)[C@H](F)CNC(=O)c1cnc(-c2ccc3cc(C#N)cnn23)cc1NC12CC[C@@H](C1)[C@@H](O)C2 -
5-(azetidine-1-carbonyl)-N-[5-(1-benzothiophen-2-yl)-4-fluoro-2-(trifluoromethoxy)phenyl]-3-chloro-2-hydroxybenzenesulfonamide PubChem CID 146545752
O=C(c1cc(Cl)c(O)c(S(=O)(=O)Nc2cc(-c3cc4ccccc4s3)c(F)cc2OC(F)(F)F)c1)N1CCC1 -
4-((cyclopropylmethyl)amino)-1- phenyl-7-(trifluoromethyl)quinazolin- 2(1H)-one PubChem CID 150333238
O=c1nc(NCC2CC2)c2ccc(C(F)(F)F)cc2n1-c1ccccc1 -
7-[[6- (diethylamino methyl)-5- tetrahydrofuran- 3-yl-2-pyridyl]amino]- 4-(7-fluoroimidazo [1,2-a]pyridin- 3-yl)isoindolin- 1-one PubChem CID 156163864
CCN(CC)Cc1nc(Nc2ccc(-c3cnc4cc(F)ccn34)c3c2C(=O)NC3)ccc1C1CCOC1 -
N-[4-[(6,7-dimethoxy-1,5- naphthyridin-4-yl)oxy]-3- fluorophenyl]-6-ethyl-5-(4- fluorophenyl)-4-hydroxypyridine-3- carboxamide PubChem CID 156197202
CCc1[nH]cc(C(=O)Nc2ccc(Oc3ccnc4cc(OC)c(OC)nc34)c(F)c2)c(=O)c1-c1ccc(F)cc1 -
2-(1-isobutyl-1H- benzo[d][1,2,3]triazol-5- yl)oxazolo[5,4-c]pyridine PubChem CID 156494097
CC(C)Cn1nnc2cc(-c3nc4ccncc4o3)ccc21