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

Systemtic Name: 2-(2,2-dimethylpropanoylamino)-5-methyl-4-(4-methylphenyl)thiophene-3-carboxylic acid Openeye Name: 2-(2,2-dimethylpropanoylamino)-5-methyl-4-(p-tolyl)thiophene-3-carboxylic acid CAS Name: 2-[(2,2-dimethyl-1-oxopropyl)amino]-5-methyl-4-(4-methylphenyl)-3-thiophenecarboxylic acid IUPAC Name: 2-(2,2-dimethylpropanoylamino)-5-methyl-4-(4-methylphenyl)thiophene-3-carboxylic acid Traditional Name: 5-methyl-2-(pivaloylamino)-4-(p-tolyl)-3-thenoic acid Formula: C18H21NO3S MolecularWeight: 331.42924

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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)C

Isomeric SMILES

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

InChI

InChI=1S/C18H21NO3S/c1-10-6-8-12(9-7-10)13-11(2)23-15(14(13)16(20)21)19-17(22)18(3,4)5/h6-9H,1-5H3,(H,19,22)(H,20,21)