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

Systemtic Name: methyl 2-[2-[methyl-[(4-methylsulfanylphenyl)methyl]amino]ethanoylamino]benzoate Openeye Name: methyl 2-[[2-[methyl-[(4-methylsulfanylphenyl)methyl]amino]acetyl]amino]benzoate CAS Name: 2-[[2-[methyl-[[4-(methylthio)phenyl]methyl]amino]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[2-[methyl-[(4-methylsulfanylphenyl)methyl]amino]acetyl]amino]benzoate Traditional Name: 2-[[2-[methyl-[4-(methylthio)benzyl]amino]acetyl]amino]benzoic acid methyl ester Formula: C19H22N2O3S MolecularWeight: 358.45458

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)SC)CC(=O)NC2=CC=CC=C2C(=O)OC

Isomeric SMILES

CN(CC1=CC=C(C=C1)SC)CC(=O)NC2=CC=CC=C2C(=O)OC

InChI

InChI=1S/C19H22N2O3S/c1-21(12-14-8-10-15(25-3)11-9-14)13-18(22)20-17-7-5-4-6-16(17)19(23)24-2/h4-11H,12-13H2,1-3H3,(H,20,22)