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

Systemtic Name: 3-[[1-(methylcarbamoyl)piperidin-4-yl]-(4-methylcyclohexyl)carbonyl-amino]-5-phenyl-thiophene-2-carboxylic acid Openeye Name: 3-[[1-(methylcarbamoyl)-4-piperidyl]-(4-methylcyclohexanecarbonyl)amino]-5-phenyl-thiophene-2-carboxylic acid CAS Name: 3-[[1-(methylcarbamoyl)-4-piperidinyl]-[(4-methylcyclohexyl)-oxomethyl]amino]-5-phenyl-2-thiophenecarboxylic acid IUPAC Name: 3-[[1-(methylcarbamoyl)piperidin-4-yl]-(4-methylcyclohexanecarbonyl)amino]-5-phenylthiophene-2-carboxylic acid Traditional Name: 3-[[1-(methylcarbamoyl)-4-piperidyl]-(4-methylcyclohexanecarbonyl)amino]-5-phenyl-2-thenoic acid Formula: C26H33N3O4S MolecularWeight: 483.62292

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)C(=O)N(C2CCN(CC2)C(=O)NC)C3=C(SC(=C3)C4=CC=CC=C4)C(=O)O

Isomeric SMILES

CC1CCC(CC1)C(=O)N(C2CCN(CC2)C(=O)NC)C3=C(SC(=C3)C4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C26H33N3O4S/c1-17-8-10-19(11-9-17)24(30)29(20-12-14-28(15-13-20)26(33)27-2)21-16-22(34-23(21)25(31)32)18-6-4-3-5-7-18/h3-7,16-17,19-20H,8-15H2,1-2H3,(H,27,33)(H,31,32)