methyl 4-methyl-2-[(2-methylsulfanylphenyl)carbonylamino]pentanoate

Systemtic Name: methyl 4-methyl-2-[(2-methylsulfanylphenyl)carbonylamino]pentanoate Openeye Name: methyl 4-methyl-2-[(2-methylsulfanylbenzoyl)amino]pentanoate CAS Name: 4-methyl-2-[[[2-(methylthio)phenyl]-oxomethyl]amino]pentanoic acid methyl ester IUPAC Name: methyl 4-methyl-2-[(2-methylsulfanylbenzoyl)amino]pentanoate Traditional Name: 4-methyl-2-[[2-(methylthio)benzoyl]amino]valeric acid methyl ester Formula: C15H21NO3S MolecularWeight: 295.39714

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OC)NC(=O)C1=CC=CC=C1SC

Isomeric SMILES

CC(C)CC(C(=O)OC)NC(=O)C1=CC=CC=C1SC

InChI

InChI=1S/C15H21NO3S/c1-10(2)9-12(15(18)19-3)16-14(17)11-7-5-6-8-13(11)20-4/h5-8,10,12H,9H2,1-4H3,(H,16,17)