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

Systemtic Name: 2-[1-methoxypropan-2-yl-(4-methylcyclohexyl)carbonyl-amino]-5-phenyl-thiophene-3-carboxylic acid Openeye Name: 2-[(2-methoxy-1-methyl-ethyl)-(4-methylcyclohexanecarbonyl)amino]-5-phenyl-thiophene-3-carboxylic acid CAS Name: 2-[1-methoxypropan-2-yl-[(4-methylcyclohexyl)-oxomethyl]amino]-5-phenyl-3-thiophenecarboxylic acid IUPAC Name: 2-[1-methoxypropan-2-yl-(4-methylcyclohexanecarbonyl)amino]-5-phenylthiophene-3-carboxylic acid Traditional Name: 2-[(2-methoxy-1-methyl-ethyl)-(4-methylcyclohexanecarbonyl)amino]-5-phenyl-3-thenoic acid Formula: C23H29NO4S MolecularWeight: 415.54566

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)C(=O)N(C2=C(C=C(S2)C3=CC=CC=C3)C(=O)O)C(C)COC

Isomeric SMILES

CC1CCC(CC1)C(=O)N(C2=C(C=C(S2)C3=CC=CC=C3)C(=O)O)C(C)COC

InChI

InChI=1S/C23H29NO4S/c1-15-9-11-18(12-10-15)21(25)24(16(2)14-28-3)22-19(23(26)27)13-20(29-22)17-7-5-4-6-8-17/h4-8,13,15-16,18H,9-12,14H2,1-3H3,(H,26,27)