methyl 2-methyl-3-(2-phenylsulfanylethanoylamino)benzoate

Systemtic Name: methyl 2-methyl-3-(2-phenylsulfanylethanoylamino)benzoate Openeye Name: methyl 2-methyl-3-[(2-phenylsulfanylacetyl)amino]benzoate CAS Name: 2-methyl-3-[[1-oxo-2-(phenylthio)ethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-methyl-3-[(2-phenylsulfanylacetyl)amino]benzoate Traditional Name: 2-methyl-3-[[2-(phenylthio)acetyl]amino]benzoic acid methyl ester Formula: C17H17NO3S MolecularWeight: 315.38678

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1NC(=O)CSC2=CC=CC=C2)C(=O)OC

Isomeric SMILES

CC1=C(C=CC=C1NC(=O)CSC2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C17H17NO3S/c1-12-14(17(20)21-2)9-6-10-15(12)18-16(19)11-22-13-7-4-3-5-8-13/h3-10H,11H2,1-2H3,(H,18,19)