5-(4,4-dimethylcyclohexyl)-3-[(4-methylcyclohexyl)carbonyl-(1-methylpiperidin-4-yl)amino]thiophene-2-carboxylic acid

Systemtic Name: 5-(4,4-dimethylcyclohexyl)-3-[(4-methylcyclohexyl)carbonyl-(1-methylpiperidin-4-yl)amino]thiophene-2-carboxylic acid Openeye Name: 5-(4,4-dimethylcyclohexyl)-3-[(4-methylcyclohexanecarbonyl)-(1-methyl-4-piperidyl)amino]thiophene-2-carboxylic acid CAS Name: 5-(4,4-dimethylcyclohexyl)-3-[[(4-methylcyclohexyl)-oxomethyl]-(1-methyl-4-piperidinyl)amino]-2-thiophenecarboxylic acid IUPAC Name: 5-(4,4-dimethylcyclohexyl)-3-[(4-methylcyclohexanecarbonyl)-(1-methylpiperidin-4-yl)amino]thiophene-2-carboxylic acid Traditional Name: 5-(4,4-dimethylcyclohexyl)-3-[(4-methylcyclohexanecarbonyl)-(1-methyl-4-piperidyl)amino]-2-thenoic acid Formula: C27H42N2O3S MolecularWeight: 474.69898

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)C(=O)N(C2CCN(CC2)C)C3=C(SC(=C3)C4CCC(CC4)(C)C)C(=O)O

Isomeric SMILES

CC1CCC(CC1)C(=O)N(C2CCN(CC2)C)C3=C(SC(=C3)C4CCC(CC4)(C)C)C(=O)O

InChI

InChI=1S/C27H42N2O3S/c1-18-5-7-20(8-6-18)25(30)29(21-11-15-28(4)16-12-21)22-17-23(33-24(22)26(31)32)19-9-13-27(2,3)14-10-19/h17-21H,5-16H2,1-4H3,(H,31,32)