3-[(4-methylcyclohexyl)carbonyl-(1-methyl-2-oxidanylidene-piperidin-4-yl)amino]-5-phenyl-thiophene-2-carboxylic acid

Systemtic Name: 3-[(4-methylcyclohexyl)carbonyl-(1-methyl-2-oxidanylidene-piperidin-4-yl)amino]-5-phenyl-thiophene-2-carboxylic acid Openeye Name: 3-[(4-methylcyclohexanecarbonyl)-(1-methyl-2-oxo-4-piperidyl)amino]-5-phenyl-thiophene-2-carboxylic acid CAS Name: 3-[[(4-methylcyclohexyl)-oxomethyl]-(1-methyl-2-oxo-4-piperidinyl)amino]-5-phenyl-2-thiophenecarboxylic acid IUPAC Name: 3-[(4-methylcyclohexanecarbonyl)-(1-methyl-2-oxopiperidin-4-yl)amino]-5-phenylthiophene-2-carboxylic acid Traditional Name: 3-[(2-keto-1-methyl-4-piperidyl)-(4-methylcyclohexanecarbonyl)amino]-5-phenyl-2-thenoic acid Formula: C25H30N2O4S MolecularWeight: 454.5817

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)C(=O)N(C2CCN(C(=O)C2)C)C3=C(SC(=C3)C4=CC=CC=C4)C(=O)O

Isomeric SMILES

CC1CCC(CC1)C(=O)N(C2CCN(C(=O)C2)C)C3=C(SC(=C3)C4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C25H30N2O4S/c1-16-8-10-18(11-9-16)24(29)27(19-12-13-26(2)22(28)14-19)20-15-21(32-23(20)25(30)31)17-6-4-3-5-7-17/h3-7,15-16,18-19H,8-14H2,1-2H3,(H,30,31)