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

Systemtic Name: 3-[(2-acetyloxy-4-methyl-phenyl)carbonyl-propan-2-yl-amino]-5-phenyl-thiophene-2-carboxylic acid Openeye Name: 3-[(2-acetoxy-4-methyl-benzoyl)-isopropyl-amino]-5-phenyl-thiophene-2-carboxylic acid CAS Name: 3-[[(2-acetyloxy-4-methylphenyl)-oxomethyl]-propan-2-ylamino]-5-phenyl-2-thiophenecarboxylic acid IUPAC Name: 3-[(2-acetyloxy-4-methylbenzoyl)-propan-2-ylamino]-5-phenylthiophene-2-carboxylic acid Traditional Name: 3-[(2-acetoxy-4-methyl-benzoyl)-isopropyl-amino]-5-phenyl-2-thenoic acid Formula: C24H23NO5S MolecularWeight: 437.50812

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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(=O)O)C(C)C)OC(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C24H23NO5S/c1-14(2)25(23(27)18-11-10-15(3)12-20(18)30-16(4)26)19-13-21(31-22(19)24(28)29)17-8-6-5-7-9-17/h5-14H,1-4H3,(H,28,29)