methyl 5-methyl-2-(3-thiophen-2-ylpropanoylamino)benzoate

Systemtic Name: methyl 5-methyl-2-(3-thiophen-2-ylpropanoylamino)benzoate Openeye Name: methyl 5-methyl-2-[3-(2-thienyl)propanoylamino]benzoate CAS Name: 5-methyl-2-[(1-oxo-3-thiophen-2-ylpropyl)amino]benzoic acid methyl ester IUPAC Name: methyl 5-methyl-2-(3-thiophen-2-ylpropanoylamino)benzoate Traditional Name: 5-methyl-2-[3-(2-thienyl)propanoylamino]benzoic acid methyl ester Formula: C16H17NO3S MolecularWeight: 303.37608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)CCC2=CC=CS2)C(=O)OC

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)CCC2=CC=CS2)C(=O)OC

InChI

InChI=1S/C16H17NO3S/c1-11-5-7-14(13(10-11)16(19)20-2)17-15(18)8-6-12-4-3-9-21-12/h3-5,7,9-10H,6,8H2,1-2H3,(H,17,18)