4-(4-ethylphenyl)-2-(propanoylamino)thiophene-3-carboxylic acid

Systemtic Name: 4-(4-ethylphenyl)-2-(propanoylamino)thiophene-3-carboxylic acid Openeye Name: 4-(4-ethylphenyl)-2-(propanoylamino)thiophene-3-carboxylic acid CAS Name: 4-(4-ethylphenyl)-2-(1-oxopropylamino)-3-thiophenecarboxylic acid IUPAC Name: 4-(4-ethylphenyl)-2-(propanoylamino)thiophene-3-carboxylic acid Traditional Name: 4-(4-ethylphenyl)-2-propionamido-3-thenoic acid Formula: C16H17NO3S MolecularWeight: 303.37608

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=CSC(=C2C(=O)O)NC(=O)CC

Isomeric SMILES

CCC1=CC=C(C=C1)C2=CSC(=C2C(=O)O)NC(=O)CC

InChI

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