3-[(4-cyanocyclohexyl)-(4-methylcyclohexyl)carbonyl-amino]-5-(cyclohexen-1-yl)thiophene-2-carboxylic acid

Systemtic Name: 3-[(4-cyanocyclohexyl)-(4-methylcyclohexyl)carbonyl-amino]-5-(cyclohexen-1-yl)thiophene-2-carboxylic acid Openeye Name: 3-[(4-cyanocyclohexyl)-(4-methylcyclohexanecarbonyl)amino]-5-(cyclohexen-1-yl)thiophene-2-carboxylic acid CAS Name: 3-[(4-cyanocyclohexyl)-[(4-methylcyclohexyl)-oxomethyl]amino]-5-(1-cyclohexenyl)-2-thiophenecarboxylic acid IUPAC Name: 3-[(4-cyanocyclohexyl)-(4-methylcyclohexanecarbonyl)amino]-5-(cyclohexen-1-yl)thiophene-2-carboxylic acid Traditional Name: 3-[(4-cyanocyclohexyl)-(4-methylcyclohexanecarbonyl)amino]-5-(cyclohexen-1-yl)-2-thenoic acid Formula: C26H34N2O3S MolecularWeight: 454.62476

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)C(=O)N(C2CCC(CC2)C#N)C3=C(SC(=C3)C4=CCCCC4)C(=O)O

Isomeric SMILES

CC1CCC(CC1)C(=O)N(C2CCC(CC2)C#N)C3=C(SC(=C3)C4=CCCCC4)C(=O)O

InChI

InChI=1S/C26H34N2O3S/c1-17-7-11-20(12-8-17)25(29)28(21-13-9-18(16-27)10-14-21)22-15-23(32-24(22)26(30)31)19-5-3-2-4-6-19/h5,15,17-18,20-21H,2-4,6-14H2,1H3,(H,30,31)