2-(propanoylamino)-4-(4-propan-2-ylphenyl)thiophene-3-carboxylic acid

Systemtic Name: 2-(propanoylamino)-4-(4-propan-2-ylphenyl)thiophene-3-carboxylic acid Openeye Name: 4-(4-isopropylphenyl)-2-(propanoylamino)thiophene-3-carboxylic acid CAS Name: 2-(1-oxopropylamino)-4-(4-propan-2-ylphenyl)-3-thiophenecarboxylic acid IUPAC Name: 2-(propanoylamino)-4-(4-propan-2-ylphenyl)thiophene-3-carboxylic acid Traditional Name: 4-p-cumenyl-2-propionamido-3-thenoic acid Formula: C17H19NO3S MolecularWeight: 317.40266

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19NO3S/c1-4-14(19)18-16-15(17(20)21)13(9-22-16)12-7-5-11(6-8-12)10(2)3/h5-10H,4H2,1-3H3,(H,18,19)(H,20,21)