methyl 2-[[1-ethanoylsulfanyl-3-(2-methylphenyl)propan-2-yl]carbamoyloxy]-2-phenyl-ethanoate

Systemtic Name: methyl 2-[[1-ethanoylsulfanyl-3-(2-methylphenyl)propan-2-yl]carbamoyloxy]-2-phenyl-ethanoate Openeye Name: methyl 2-[[1-(acetylsulfanylmethyl)-2-(o-tolyl)ethyl]carbamoyloxy]-2-phenyl-acetate CAS Name: 2-[[[1-(acetylthio)-3-(2-methylphenyl)propan-2-yl]amino]-oxomethoxy]-2-phenylacetic acid methyl ester IUPAC Name: methyl 2-[[1-acetylsulfanyl-3-(2-methylphenyl)propan-2-yl]carbamoyloxy]-2-phenylacetate Traditional Name: 2-[[1-[(acetylthio)methyl]-2-(o-tolyl)ethyl]carbamoyloxy]-2-phenyl-acetic acid methyl ester Formula: C22H25NO5S MolecularWeight: 415.5026

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CC(CSC(=O)C)NC(=O)OC(C2=CC=CC=C2)C(=O)OC

Isomeric SMILES

CC1=CC=CC=C1CC(CSC(=O)C)NC(=O)OC(C2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C22H25NO5S/c1-15-9-7-8-12-18(15)13-19(14-29-16(2)24)23-22(26)28-20(21(25)27-3)17-10-5-4-6-11-17/h4-12,19-20H,13-14H2,1-3H3,(H,23,26)