← Back

名称: 5-(3,3-Dimethyl-but-1-ynyl)-3-[[2-(ethoxy-methyl-phosphinoyl)-ethyl]-(4-methyl-cyclohexanecarbonyl)-amino]-thiophene-2-carboxylic acid

IUPAC: 5-(3,3-dimethylbut-1-ynyl)-3-[2-[ethoxy(methyl)phosphoryl]ethyl-(4-methylcyclohexanecarbonyl)amino]thiophene-2-carboxylic acid

SMILES: CCOP(C)(=O)CCN(C(=O)C1CCC(C)CC1)c1cc(C#CC(C)(C)C)sc1C(=O)O

Canonical SMILES: CCOP(=O)(C)CCN(C1=C(SC(=C1)C#CC(C)(C)C)C(=O)O)C(=O)C2CCC(CC2)C

分子式: C24H36NO5PS

分子量: 481.60

InChIKey: VJFYXSBTYFLSMZ-UHFFFAOYSA-N

InChI: InChI=1S/C24H36NO5PS/c1-7-30-31(6,29)15-14-25(22(26)18-10-8-17(2)9-11-18)20-16-19(12-13-24(3,4)5)32-21(20)23(27)28/h16-18H,7-11,14-15H2,1-6H3,(H,27,28)

PubChem CID: 67035914 →

同義語

SCHEMBL1443545SCHEMBL9961539VJFYXSBTYFLSMZ-UHFFFAOYSA-N5-(3,3-Dimethyl-but-1-ynyl)-3-[[2-(ethoxy-methyl-phosphinoyl)-ethyl]-(4-methyl-cyclohexanecarbonyl)-amino]-thiophene-2-carboxylic acid

拡張検索

部分構造検索→類似構造検索→