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

Systemtic Name: 2-[(4-methylcyclohexyl)carbonyl-(oxan-4-yl)amino]-5-phenyl-thiophene-3-carboxylic acid Openeye Name: 2-[(4-methylcyclohexanecarbonyl)-tetrahydropyran-4-yl-amino]-5-phenyl-thiophene-3-carboxylic acid CAS Name: 2-[[(4-methylcyclohexyl)-oxomethyl]-(4-oxanyl)amino]-5-phenyl-3-thiophenecarboxylic acid IUPAC Name: 2-[(4-methylcyclohexanecarbonyl)-(oxan-4-yl)amino]-5-phenylthiophene-3-carboxylic acid Traditional Name: 2-[(4-methylcyclohexanecarbonyl)-tetrahydropyran-4-yl-amino]-5-phenyl-3-thenoic acid Formula: C24H29NO4S MolecularWeight: 427.55636

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)C(=O)N(C2CCOCC2)C3=C(C=C(S3)C4=CC=CC=C4)C(=O)O

Isomeric SMILES

CC1CCC(CC1)C(=O)N(C2CCOCC2)C3=C(C=C(S3)C4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C24H29NO4S/c1-16-7-9-18(10-8-16)22(26)25(19-11-13-29-14-12-19)23-20(24(27)28)15-21(30-23)17-5-3-2-4-6-17/h2-6,15-16,18-19H,7-14H2,1H3,(H,27,28)