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

Systemtic Name: methyl 4-methyl-3-[2-(4-methylphenyl)sulfanylpropanoylamino]benzoate Openeye Name: methyl 4-methyl-3-[2-(p-tolylsulfanyl)propanoylamino]benzoate CAS Name: 4-methyl-3-[[2-[(4-methylphenyl)thio]-1-oxopropyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-methyl-3-[2-(4-methylphenyl)sulfanylpropanoylamino]benzoate Traditional Name: 4-methyl-3-[2-(p-tolylthio)propanoylamino]benzoic acid methyl ester Formula: C19H21NO3S MolecularWeight: 343.43994

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21NO3S/c1-12-5-9-16(10-6-12)24-14(3)18(21)20-17-11-15(19(22)23-4)8-7-13(17)2/h5-11,14H,1-4H3,(H,20,21)