methyl 3-[2-(4-methylphenyl)sulfanylethanoylamino]benzoate

Systemtic Name: methyl 3-[2-(4-methylphenyl)sulfanylethanoylamino]benzoate Openeye Name: methyl 3-[[2-(p-tolylsulfanyl)acetyl]amino]benzoate CAS Name: 3-[[2-[(4-methylphenyl)thio]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[[2-(4-methylphenyl)sulfanylacetyl]amino]benzoate Traditional Name: 3-[[2-(p-tolylthio)acetyl]amino]benzoic acid methyl ester Formula: C17H17NO3S MolecularWeight: 315.38678

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC(=O)NC2=CC=CC(=C2)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)SCC(=O)NC2=CC=CC(=C2)C(=O)OC

InChI

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