methyl 2-methoxy-5-[[2-(4-methylphenyl)sulfanylpropanoylamino]methyl]benzoate

Systemtic Name: methyl 2-methoxy-5-[[2-(4-methylphenyl)sulfanylpropanoylamino]methyl]benzoate Openeye Name: methyl 2-methoxy-5-[[2-(p-tolylsulfanyl)propanoylamino]methyl]benzoate CAS Name: 2-methoxy-5-[[[2-[(4-methylphenyl)thio]-1-oxopropyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 2-methoxy-5-[[2-(4-methylphenyl)sulfanylpropanoylamino]methyl]benzoate Traditional Name: 2-methoxy-5-[[2-(p-tolylthio)propanoylamino]methyl]benzoic acid methyl ester Formula: C20H23NO4S MolecularWeight: 373.46592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC(C)C(=O)NCC2=CC(=C(C=C2)OC)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)SC(C)C(=O)NCC2=CC(=C(C=C2)OC)C(=O)OC

InChI

InChI=1S/C20H23NO4S/c1-13-5-8-16(9-6-13)26-14(2)19(22)21-12-15-7-10-18(24-3)17(11-15)20(23)25-4/h5-11,14H,12H2,1-4H3,(H,21,22)