Compound Search
化合物数据库
基于 PubChem CID 索引,支持名称 / 同义词 / CAS / SMILES 检索。
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Nc1sc(N)c2c1CCNC2 -
2-Methoxy-5-methyl-N,N-bis(1-methylethyl)-?-phenylbenzenepropanamine (2E)-2-Butenedioate; N,N-Diisopropyl-3-(2-methoxy-5-methylphenyl)-3-phenylpropylamine Fumarate; N-[3-(2-Methoxy-5-methylphenyl)-3-phenylpropyl]diisopropylamine Fumarate; 2-[3-[Bis(1-methylethyl)amino]-1-phenyl-propyl]-4-methyl-methoxybenzene Fumarate; CAS 124935-88-2 PubChem CID 45357480
COc1ccc(C)cc1C(CCN(C(C)C)C(C)C)c1ccccc1.O=C(O)/C=C/C(=O)O -
NCGC00381170-01_C23H32O6_2,4-Octadienoic acid, 7-hydroxy-, 1,3,5,5a,6,7,8,9,9a,9b-decahydro-9b-hydroxy-6,6,9a-trimethyl-1-oxonaphtho[1,2-c]furan-5-yl ester, (2E,4E)- CAS 1188398-15-3 PubChem CID 45359178
CC(O)C/C=C/C=C/C(=O)OC1C=C2COC(=O)C2(O)C2(C)CCCC(C)(C)C12 -
(1S,6S,7R)-6-(ACETYLOXY)-1-[(3-METHYLBUTANOYL)OXY]-4A,5,6,7A-TETRAHYDRO-1H-SPIRO[CYCLOPENTA[C]PYRAN-7,2'-OXIRAN]-4-YLMETHYL 3-METHYLBUTANOATE PubChem CID 45359818
CC(=O)O[C@H]1CC2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)C2[C@@]12CO2 -
(2S)-6-Fluoro-3,4-dihydro-2-[(2R)-2-oxiranyl]-2H-1-benzopyran; 2H-1-Benzopyran, 6-fluoro-3,4-dihydro-2-oxiranyl-, [S-(R*,S*)]; (2R)-2-((2S)-6-Fluoro-3,4-dihydro-2H-1-benzopyran-2-yl)oxirane CAS 876514-31-7 PubChem CID 51698391
Fc1ccc2c(c1)CC[C@@H]([C@H]1CO1)O2 -
6-[[(1R,2S)-2-Aminocyclohexyl]amino]-7-chloro-1,2-dihydro-4-(1-methyl-1H-pyrazol-4-yl)-3H-pyrrolo[3,4-c]pyridin-3-one CAS 1312691-36-3 PubChem CID 53252278
Cn1cc(-c2nc(N[C@@H]3CCCC[C@@H]3N)c(Cl)c3c2C(=O)NC3)cn1 -
NC(=O)c1cccnc1.O=C1O[C@H]([C@@H](O)CO)C(O)=C1O -
NCGC00380634-01!2,3,4,9,10-pentamethoxy-6a,11a-dihydro-6H-[1]benzofuro[3,2-c]chromen-8-ol CAS 1371184-78-9 PubChem CID 56776328
COc1cc2c(c(OC)c1OC)OCC1c3cc(O)c(OC)c(OC)c3OC21 -
N-(2-Butyl-3-(4-(3-(dibutylamino)propoxy)-benzoyl)benzofuran-5-yl)-N-(methylsulfonyl)methanesulfonamide (Dronedarone Impurity) CAS 141626-57-5 PubChem CID 56941271
CCCCc1oc2ccc(N(S(C)(=O)=O)S(C)(=O)=O)cc2c1C(=O)c1ccc(OCCCN(CCCC)CCCC)cc1 -
[4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]methyl 2,3-dihydroxy-3-methylpentanoate PubChem CID 57509396
CCC(C)(O)C(O)C(=O)OCc1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1 -
Methyl 5-[(3-chloro-4-fluorophenyl)amino]pyrimido[4,5-c]quinoline-8-carboxylate CAS 1009821-08-2 PubChem CID 57664043
COC(=O)c1ccc2c(c1)nc(Nc1ccc(F)c(Cl)c1)c1ncncc12 -
3-[5-(1-methyl-1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-1 H-pyrrolo[2,3-c]pyridine PubChem CID 59053719
Cn1cc(-c2cnc3[nH]cc(-c4c[nH]c5cnccc45)c3c2)cn1 -
4,4-Dimethyl-7-(1,1-dimethylheptyl)-2,4-dihydro[1]benzopyrano[4,3-c]pyrazole-6,9-dione PubChem CID 60148509
CCCCCCC(C)(C)C1=CC(=O)C2=C(OC(C)(C)c3cn[nH]c32)C1=O -
(5-Amino-2-butylbenzofuran-3-yl)(4-hydroxyphenyl)methanone (Dronedarone Impurity) CAS 1278585-68-4 PubChem CID 69096654
CCCCc1oc2ccc(N)cc2c1C(=O)c1ccc(O)cc1 -
ss-Alanine, N-[[2-[[[4-[[[(hexyloxy)carbonyl]amino]carbonyl]phenyl]amino]methyl]-1-methyl-1H-benzimidazol-5-yl]carbonyl]-N-2-pyridinyl-, ethyl ester; ethyl N-[(2-{[(4-{[(hexyloxy)carbonyl]carbamoyl}phenyl)amino]methyl}-1-methyl-1H-benzimidazol-5-yl) carbonyl]-N-pyridin-2-yl-ss-alaninate; Dabigatran Etexilate Amid Analogon CAS 1408238-40-3 PubChem CID 70968095
CCCCCCOC(=O)NC(=O)c1ccc(NCc2nc3cc(C(=O)N(CCC(=O)OCC)c4ccccn4)ccc3n2C)cc1 -
(2S,3R,4R,5S,6R)-2-(7-chloro-6-(4-cyclopropylbenzyl)-2,3-dihydrobenzofuran-4-yl)-6-(hydroxymethyl)tetrahydro-2H-pyran-3,4,5-triol CAS 1415472-28-4 PubChem CID 71076840
OC[C@H]1O[C@@H](c2cc(Cc3ccc(C4CC4)cc3)c(Cl)c3c2CCO3)[C@H](O)[C@@H](O)[C@@H]1O -
(R)-4-(4-(5-cyano-8-cyclopropyl-3,3-dim ethyl-3,4-dihydro-1H-pyrano[3,4-c]pyridin-6-yl)-2-isopropylpiperazin-1-yl)-4-oxobutanoic acid PubChem CID 71118785
CC(C)[C@@H]1CN(c2nc(C3CC3)c3c(c2C#N)CC(C)(C)OC3)CCN1C(=O)CCC(=O)O -
(R)-8-cyclopropyl-6-(3-cyclopropyl-4-(3-methoxypropanoyl)piperazin-1-yl)-3,3-dimethyl-3,4-dihydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile CAS 1416270-18-2 PubChem CID 71119107
COCCC(=O)N1CCN(c2nc(C3CC3)c3c(c2C#N)CC(C)(C)OC3)C[C@H]1C1CC1 -
(OC-6-33)-[(1R,2R)-1,2-Cyclohexanediamine-|EN1,|EN2][ethanedioato(2-)-|EO1,|EO2]dihydroxyplatinum CAS 111321-67-6 PubChem CID 71316264
O=C([O-])C(=O)[O-].[NH-][C@@H]1CCCC[C@H]1[NH-].[OH-].[OH-].[Pt] -
1-(9-Chloropyrido[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-5-yl)-N-methyl-3-azetidinamine CAS 1429374-95-7 PubChem CID 71547931
CNC1CN(c2nc3ncc(Cl)cc3c3ncnn23)C1