5-methyl-4-(4-methylphenyl)-2-(2-methylpropanoylamino)thiophene-3-carboxylic acid

Systemtic Name: 5-methyl-4-(4-methylphenyl)-2-(2-methylpropanoylamino)thiophene-3-carboxylic acid Openeye Name: 5-methyl-2-(2-methylpropanoylamino)-4-(p-tolyl)thiophene-3-carboxylic acid CAS Name: 5-methyl-2-[(2-methyl-1-oxopropyl)amino]-4-(4-methylphenyl)-3-thiophenecarboxylic acid IUPAC Name: 5-methyl-4-(4-methylphenyl)-2-(2-methylpropanoylamino)thiophene-3-carboxylic acid Traditional Name: 2-(isobutyrylamino)-5-methyl-4-(p-tolyl)-3-thenoic acid Formula: C17H19NO3S MolecularWeight: 317.40266

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(SC(=C2C(=O)O)NC(=O)C(C)C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(SC(=C2C(=O)O)NC(=O)C(C)C)C

InChI

InChI=1S/C17H19NO3S/c1-9(2)15(19)18-16-14(17(20)21)13(11(4)22-16)12-7-5-10(3)6-8-12/h5-9H,1-4H3,(H,18,19)(H,20,21)