methyl 2-(3-phenylsulfanylpropanoylamino)benzoate

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

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC(=O)CCSC2=CC=CC=C2

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC(=O)CCSC2=CC=CC=C2

InChI

InChI=1S/C17H17NO3S/c1-21-17(20)14-9-5-6-10-15(14)18-16(19)11-12-22-13-7-3-2-4-8-13/h2-10H,11-12H2,1H3,(H,18,19)