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

Systemtic Name: 5-(4-fluorophenyl)-3-[(4-methylcyclohexyl)carbonyl-(4-oxidanylcyclohexyl)amino]thiophene-2-carboxylic acid Openeye Name: 5-(4-fluorophenyl)-3-[(4-hydroxycyclohexyl)-(4-methylcyclohexanecarbonyl)amino]thiophene-2-carboxylic acid CAS Name: 5-(4-fluorophenyl)-3-[(4-hydroxycyclohexyl)-[(4-methylcyclohexyl)-oxomethyl]amino]-2-thiophenecarboxylic acid IUPAC Name: 5-(4-fluorophenyl)-3-[(4-hydroxycyclohexyl)-(4-methylcyclohexanecarbonyl)amino]thiophene-2-carboxylic acid Traditional Name: 5-(4-fluorophenyl)-3-[(4-hydroxycyclohexyl)-(4-methylcyclohexanecarbonyl)amino]-2-thenoic acid Formula: C25H30FNO4S MolecularWeight: 459.573403

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)C(=O)N(C2CCC(CC2)O)C3=C(SC(=C3)C4=CC=C(C=C4)F)C(=O)O

Isomeric SMILES

CC1CCC(CC1)C(=O)N(C2CCC(CC2)O)C3=C(SC(=C3)C4=CC=C(C=C4)F)C(=O)O

InChI

InChI=1S/C25H30FNO4S/c1-15-2-4-17(5-3-15)24(29)27(19-10-12-20(28)13-11-19)21-14-22(32-23(21)25(30)31)16-6-8-18(26)9-7-16/h6-9,14-15,17,19-20,28H,2-5,10-13H2,1H3,(H,30,31)