(phenylmethyl) N-[1-[(2-methylphenyl)amino]-1-oxidanylidene-3-(phenylmethylsulfanyl)propan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[1-[(2-methylphenyl)amino]-1-oxidanylidene-3-(phenylmethylsulfanyl)propan-2-yl]carbamate Openeye Name: benzyl N-[1-(benzylsulfanylmethyl)-2-(2-methylanilino)-2-oxo-ethyl]carbamate CAS Name: N-[1-(2-methylanilino)-1-oxo-3-(phenylmethylthio)propan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[3-benzylsulfanyl-1-(2-methylanilino)-1-oxopropan-2-yl]carbamate Traditional Name: N-[1-[(benzylthio)methyl]-2-keto-2-(o-toluidino)ethyl]carbamic acid benzyl ester Formula: C25H26N2O3S MolecularWeight: 434.55054

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)C(CSCC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC=C1NC(=O)C(CSCC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C25H26N2O3S/c1-19-10-8-9-15-22(19)26-24(28)23(18-31-17-21-13-6-3-7-14-21)27-25(29)30-16-20-11-4-2-5-12-20/h2-15,23H,16-18H2,1H3,(H,26,28)(H,27,29)