5-(3-methylphenyl)-3-[(4-methylphenyl)carbonyl-propan-2-yl-amino]thiophene-2-carboxylic acid

Systemtic Name: 5-(3-methylphenyl)-3-[(4-methylphenyl)carbonyl-propan-2-yl-amino]thiophene-2-carboxylic acid Openeye Name: 3-[isopropyl-(4-methylbenzoyl)amino]-5-(m-tolyl)thiophene-2-carboxylic acid CAS Name: 5-(3-methylphenyl)-3-[[(4-methylphenyl)-oxomethyl]-propan-2-ylamino]-2-thiophenecarboxylic acid IUPAC Name: 3-[(4-methylbenzoyl)-propan-2-ylamino]-5-(3-methylphenyl)thiophene-2-carboxylic acid Traditional Name: 3-[isopropyl(p-toluoyl)amino]-5-(m-tolyl)-2-thenoic acid Formula: C23H23NO3S MolecularWeight: 393.49862

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H23NO3S/c1-14(2)24(22(25)17-10-8-15(3)9-11-17)19-13-20(28-21(19)23(26)27)18-7-5-6-16(4)12-18/h5-14H,1-4H3,(H,26,27)