methyl 4-[[2-[(2-methylphenyl)methylsulfanyl]ethanoylamino]methyl]benzoate

Systemtic Name: methyl 4-[[2-[(2-methylphenyl)methylsulfanyl]ethanoylamino]methyl]benzoate Openeye Name: methyl 4-[[[2-(o-tolylmethylsulfanyl)acetyl]amino]methyl]benzoate CAS Name: 4-[[[2-[(2-methylphenyl)methylthio]-1-oxoethyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[[2-[(2-methylphenyl)methylsulfanyl]acetyl]amino]methyl]benzoate Traditional Name: 4-[[[2-[(2-methylbenzyl)thio]acetyl]amino]methyl]benzoic acid methyl ester Formula: C19H21NO3S MolecularWeight: 343.43994

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSCC(=O)NCC2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CC1=CC=CC=C1CSCC(=O)NCC2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C19H21NO3S/c1-14-5-3-4-6-17(14)12-24-13-18(21)20-11-15-7-9-16(10-8-15)19(22)23-2/h3-10H,11-13H2,1-2H3,(H,20,21)