3-[(4-methylcyclohexyl)carbonyl-propan-2-yl-amino]-5-[4-(trifluoromethyl)phenyl]thiophene-2-carboxylic acid

Systemtic Name: 3-[(4-methylcyclohexyl)carbonyl-propan-2-yl-amino]-5-[4-(trifluoromethyl)phenyl]thiophene-2-carboxylic acid Openeye Name: 3-[isopropyl-(4-methylcyclohexanecarbonyl)amino]-5-[4-(trifluoromethyl)phenyl]thiophene-2-carboxylic acid CAS Name: 3-[[(4-methylcyclohexyl)-oxomethyl]-propan-2-ylamino]-5-[4-(trifluoromethyl)phenyl]-2-thiophenecarboxylic acid IUPAC Name: 3-[(4-methylcyclohexanecarbonyl)-propan-2-ylamino]-5-[4-(trifluoromethyl)phenyl]thiophene-2-carboxylic acid Traditional Name: 3-[isopropyl-(4-methylcyclohexanecarbonyl)amino]-5-[4-(trifluoromethyl)phenyl]-2-thenoic acid Formula: C23H26F3NO3S MolecularWeight: 453.51765

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)C(=O)N(C2=C(SC(=C2)C3=CC=C(C=C3)C(F)(F)F)C(=O)O)C(C)C

Isomeric SMILES

CC1CCC(CC1)C(=O)N(C2=C(SC(=C2)C3=CC=C(C=C3)C(F)(F)F)C(=O)O)C(C)C

InChI

InChI=1S/C23H26F3NO3S/c1-13(2)27(21(28)16-6-4-14(3)5-7-16)18-12-19(31-20(18)22(29)30)15-8-10-17(11-9-15)23(24,25)26/h8-14,16H,4-7H2,1-3H3,(H,29,30)