COP1(=O)CCC(N(c2cc(C#CC(C)(C)C)sc2C(=O)O)C(=O)[C@H]2CC[C@H](C)CC2)CC1

이름: 5-(3,3-Dimethyl-but-1-ynyl)-3-[(1-methoxy-1-oxo-1λ5-phosphinan-4-yl)-(trans-4-methyl-cyclohexanecarbonyl)-amino]-thiophene-2-carboxylic acid

IUPAC: 5-(3,3-dimethylbut-1-ynyl)-3-[(1-methoxy-1-oxo-1lambda5-phosphinan-4-yl)-(4-methylcyclohexanecarbonyl)amino]thiophene-2-carboxylic acid

SMILES: COP1(=O)CCC(N(c2cc(C#CC(C)(C)C)sc2C(=O)O)C(=O)[C@H]2CC[C@H](C)CC2)CC1

Canonical SMILES: CC1CCC(CC1)C(=O)N(C2CCP(=O)(CC2)OC)C3=C(SC(=C3)C#CC(C)(C)C)C(=O)O

분자식: C25H36NO5PS

분자량: 493.60

InChIKey: HCJUBSUIEMTLEG-UHFFFAOYSA-N

InChI:

InChI=1S/C25H36NO5PS/c1-17-6-8-18(9-7-17)23(27)26(19-11-14-32(30,31-5)15-12-19)21-16-20(10-13-25(2,3)4)33-22(21)24(28)29/h16-19H,6-9,11-12,14-15H2,1-5H3,(H,28,29)

PubChem CID: 52917226 →

동의어

SCHEMBL9932367HCJUBSUIEMTLEG-IFJPSIRDSA-N5-(3,3-Dimethyl-but-1-ynyl)-3-[(1-methoxy-1-oxo-1lambda5-phosphinan-4-yl)-(trans-4-methyl-cyclohexanecarbonyl)-amino]-thiophene-2-carboxylic acid

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