methyl 2-[(2-ethanoylsulfanyl-4-phenyl-butanoyl)amino]-4-methyl-pentanoate

Systemtic Name: methyl 2-[(2-ethanoylsulfanyl-4-phenyl-butanoyl)amino]-4-methyl-pentanoate Openeye Name: methyl 2-[(2-acetylsulfanyl-4-phenyl-butanoyl)amino]-4-methyl-pentanoate CAS Name: 2-[[2-(acetylthio)-1-oxo-4-phenylbutyl]amino]-4-methylpentanoic acid methyl ester IUPAC Name: methyl 2-[(2-acetylsulfanyl-4-phenylbutanoyl)amino]-4-methylpentanoate Traditional Name: 2-[[2-(acetylthio)-4-phenyl-butanoyl]amino]-4-methyl-valeric acid methyl ester Formula: C19H27NO4S MolecularWeight: 365.48698

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OC)NC(=O)C(CCC1=CC=CC=C1)SC(=O)C

Isomeric SMILES

CC(C)CC(C(=O)OC)NC(=O)C(CCC1=CC=CC=C1)SC(=O)C

InChI

InChI=1S/C19H27NO4S/c1-13(2)12-16(19(23)24-4)20-18(22)17(25-14(3)21)11-10-15-8-6-5-7-9-15/h5-9,13,16-17H,10-12H2,1-4H3,(H,20,22)