methyl 3-(2-phenylsulfanylpropanoylamino)benzoate

Systemtic Name: methyl 3-(2-phenylsulfanylpropanoylamino)benzoate Openeye Name: methyl 3-(2-phenylsulfanylpropanoylamino)benzoate CAS Name: 3-[[1-oxo-2-(phenylthio)propyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-(2-phenylsulfanylpropanoylamino)benzoate Traditional Name: 3-[2-(phenylthio)propanoylamino]benzoic acid methyl ester Formula: C17H17NO3S MolecularWeight: 315.38678

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC(=C1)C(=O)OC)SC2=CC=CC=C2

Isomeric SMILES

CC(C(=O)NC1=CC=CC(=C1)C(=O)OC)SC2=CC=CC=C2

InChI

InChI=1S/C17H17NO3S/c1-12(22-15-9-4-3-5-10-15)16(19)18-14-8-6-7-13(11-14)17(20)21-2/h3-12H,1-2H3,(H,18,19)