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

Systemtic Name: 5-(4-methylcyclohexen-1-yl)-3-[(4-methylcyclohexyl)carbonyl-(4-oxidanylcyclohexyl)amino]thiophene-2-carboxylic acid Openeye Name: 3-[(4-hydroxycyclohexyl)-(4-methylcyclohexanecarbonyl)amino]-5-(4-methylcyclohexen-1-yl)thiophene-2-carboxylic acid CAS Name: 3-[(4-hydroxycyclohexyl)-[(4-methylcyclohexyl)-oxomethyl]amino]-5-(4-methyl-1-cyclohexenyl)-2-thiophenecarboxylic acid IUPAC Name: 3-[(4-hydroxycyclohexyl)-(4-methylcyclohexanecarbonyl)amino]-5-(4-methylcyclohexen-1-yl)thiophene-2-carboxylic acid Traditional Name: 3-[(4-hydroxycyclohexyl)-(4-methylcyclohexanecarbonyl)amino]-5-(4-methylcyclohexen-1-yl)-2-thenoic acid Formula: C26H37NO4S MolecularWeight: 459.64128

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)C(=O)N(C2CCC(CC2)O)C3=C(SC(=C3)C4=CCC(CC4)C)C(=O)O

Isomeric SMILES

CC1CCC(CC1)C(=O)N(C2CCC(CC2)O)C3=C(SC(=C3)C4=CCC(CC4)C)C(=O)O

InChI

InChI=1S/C26H37NO4S/c1-16-3-7-18(8-4-16)23-15-22(24(32-23)26(30)31)27(20-11-13-21(28)14-12-20)25(29)19-9-5-17(2)6-10-19/h7,15-17,19-21,28H,3-6,8-14H2,1-2H3,(H,30,31)