3-[2-hydroxyethyl-(4-methylphenyl)carbonyl-amino]-5-phenyl-thiophene-2-carboxylic acid

Systemtic Name: 3-[2-hydroxyethyl-(4-methylphenyl)carbonyl-amino]-5-phenyl-thiophene-2-carboxylic acid Openeye Name: 3-[2-hydroxyethyl-(4-methylbenzoyl)amino]-5-phenyl-thiophene-2-carboxylic acid CAS Name: 3-[2-hydroxyethyl-[(4-methylphenyl)-oxomethyl]amino]-5-phenyl-2-thiophenecarboxylic acid IUPAC Name: 3-[2-hydroxyethyl-(4-methylbenzoyl)amino]-5-phenylthiophene-2-carboxylic acid Traditional Name: 3-[2-hydroxyethyl(p-toluoyl)amino]-5-phenyl-2-thenoic acid Formula: C21H19NO4S MolecularWeight: 381.44486

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N(CCO)C2=C(SC(=C2)C3=CC=CC=C3)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N(CCO)C2=C(SC(=C2)C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C21H19NO4S/c1-14-7-9-16(10-8-14)20(24)22(11-12-23)17-13-18(27-19(17)21(25)26)15-5-3-2-4-6-15/h2-10,13,23H,11-12H2,1H3,(H,25,26)