4-methyl-2-[(4-methylphenyl)carbonylamino]-5-propyl-thiophene-3-carboxylic acid

Systemtic Name: 4-methyl-2-[(4-methylphenyl)carbonylamino]-5-propyl-thiophene-3-carboxylic acid Openeye Name: 4-methyl-2-[(4-methylbenzoyl)amino]-5-propyl-thiophene-3-carboxylic acid CAS Name: 4-methyl-2-[[(4-methylphenyl)-oxomethyl]amino]-5-propyl-3-thiophenecarboxylic acid IUPAC Name: 4-methyl-2-[(4-methylbenzoyl)amino]-5-propylthiophene-3-carboxylic acid Traditional Name: 4-methyl-5-propyl-2-(p-toluoylamino)-3-thenoic acid Formula: C17H19NO3S MolecularWeight: 317.40266

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=C(S1)NC(=O)C2=CC=C(C=C2)C)C(=O)O)C

Isomeric SMILES

CCCC1=C(C(=C(S1)NC(=O)C2=CC=C(C=C2)C)C(=O)O)C

InChI

InChI=1S/C17H19NO3S/c1-4-5-13-11(3)14(17(20)21)16(22-13)18-15(19)12-8-6-10(2)7-9-12/h6-9H,4-5H2,1-3H3,(H,18,19)(H,20,21)