methyl 4-methyl-3-[2-[(2-methylsulfanylphenyl)amino]ethanoylamino]benzoate

Systemtic Name: methyl 4-methyl-3-[2-[(2-methylsulfanylphenyl)amino]ethanoylamino]benzoate Openeye Name: methyl 4-methyl-3-[[2-(2-methylsulfanylanilino)acetyl]amino]benzoate CAS Name: 4-methyl-3-[[2-[2-(methylthio)anilino]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-methyl-3-[[2-(2-methylsulfanylanilino)acetyl]amino]benzoate Traditional Name: 4-methyl-3-[[2-[2-(methylthio)anilino]acetyl]amino]benzoic acid methyl ester Formula: C18H20N2O3S MolecularWeight: 344.428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CNC2=CC=CC=C2SC

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CNC2=CC=CC=C2SC

InChI

InChI=1S/C18H20N2O3S/c1-12-8-9-13(18(22)23-2)10-15(12)20-17(21)11-19-14-6-4-5-7-16(14)24-3/h4-10,19H,11H2,1-3H3,(H,20,21)