5-(3-ethanoylphenyl)-3-[methyl-(4-methylphenyl)carbonyl-amino]thiophene-2-carboxylic acid

Systemtic Name: 5-(3-ethanoylphenyl)-3-[methyl-(4-methylphenyl)carbonyl-amino]thiophene-2-carboxylic acid Openeye Name: 5-(3-acetylphenyl)-3-[methyl-(4-methylbenzoyl)amino]thiophene-2-carboxylic acid CAS Name: 5-(3-acetylphenyl)-3-[methyl-[(4-methylphenyl)-oxomethyl]amino]-2-thiophenecarboxylic acid IUPAC Name: 5-(3-acetylphenyl)-3-[methyl-(4-methylbenzoyl)amino]thiophene-2-carboxylic acid Traditional Name: 5-(3-acetylphenyl)-3-[methyl(p-toluoyl)amino]-2-thenoic acid Formula: C22H19NO4S MolecularWeight: 393.45556

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H19NO4S/c1-13-7-9-15(10-8-13)21(25)23(3)18-12-19(28-20(18)22(26)27)17-6-4-5-16(11-17)14(2)24/h4-12H,1-3H3,(H,26,27)