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

Systemtic Name: 5-(cyclohexen-1-yl)-3-[cyclopropyl-(4-methylcyclohexyl)carbonyl-amino]thiophene-2-carboxylic acid Openeye Name: 5-(cyclohexen-1-yl)-3-[cyclopropyl-(4-methylcyclohexanecarbonyl)amino]thiophene-2-carboxylic acid CAS Name: 5-(1-cyclohexenyl)-3-[cyclopropyl-[(4-methylcyclohexyl)-oxomethyl]amino]-2-thiophenecarboxylic acid IUPAC Name: 5-(cyclohexen-1-yl)-3-[cyclopropyl-(4-methylcyclohexanecarbonyl)amino]thiophene-2-carboxylic acid Traditional Name: 5-(cyclohexen-1-yl)-3-[cyclopropyl-(4-methylcyclohexanecarbonyl)amino]-2-thenoic acid Formula: C22H29NO3S MolecularWeight: 387.53556

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)C(=O)N(C2CC2)C3=C(SC(=C3)C4=CCCCC4)C(=O)O

Isomeric SMILES

CC1CCC(CC1)C(=O)N(C2CC2)C3=C(SC(=C3)C4=CCCCC4)C(=O)O

InChI

InChI=1S/C22H29NO3S/c1-14-7-9-16(10-8-14)21(24)23(17-11-12-17)18-13-19(27-20(18)22(25)26)15-5-3-2-4-6-15/h5,13-14,16-17H,2-4,6-12H2,1H3,(H,25,26)