(phenylmethyl) N-[1-(4-methylsulfanylphenyl)-3-oxidanyl-4-oxidanylidene-butan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[1-(4-methylsulfanylphenyl)-3-oxidanyl-4-oxidanylidene-butan-2-yl]carbamate Openeye Name: benzyl N-[2-hydroxy-1-[(4-methylsulfanylphenyl)methyl]-3-oxo-propyl]carbamate CAS Name: N-[3-hydroxy-1-[4-(methylthio)phenyl]-4-oxobutan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[3-hydroxy-1-(4-methylsulfanylphenyl)-4-oxobutan-2-yl]carbamate Traditional Name: N-[2-hydroxy-3-keto-1-[4-(methylthio)benzyl]propyl]carbamic acid benzyl ester Formula: C19H21NO4S MolecularWeight: 359.43934

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)CC(C(C=O)O)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CSC1=CC=C(C=C1)CC(C(C=O)O)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C19H21NO4S/c1-25-16-9-7-14(8-10-16)11-17(18(22)12-21)20-19(23)24-13-15-5-3-2-4-6-15/h2-10,12,17-18,22H,11,13H2,1H3,(H,20,23)