2-(butanoylamino)-4-(4-methylphenyl)thiophene-3-carboxylic acid

Systemtic Name: 2-(butanoylamino)-4-(4-methylphenyl)thiophene-3-carboxylic acid Openeye Name: 2-(butanoylamino)-4-(p-tolyl)thiophene-3-carboxylic acid CAS Name: 4-(4-methylphenyl)-2-(1-oxobutylamino)-3-thiophenecarboxylic acid IUPAC Name: 2-(butanoylamino)-4-(4-methylphenyl)thiophene-3-carboxylic acid Traditional Name: 2-butyramido-4-(p-tolyl)-3-thenoic acid Formula: C16H17NO3S MolecularWeight: 303.37608

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=C(C(=CS1)C2=CC=C(C=C2)C)C(=O)O

Isomeric SMILES

CCCC(=O)NC1=C(C(=CS1)C2=CC=C(C=C2)C)C(=O)O

InChI

InChI=1S/C16H17NO3S/c1-3-4-13(18)17-15-14(16(19)20)12(9-21-15)11-7-5-10(2)6-8-11/h5-9H,3-4H2,1-2H3,(H,17,18)(H,19,20)