N-(2,4-dimethylpentan-3-yl)-2-(phenylmethylsulfanyl)propanamide

Systemtic Name: N-(2,4-dimethylpentan-3-yl)-2-(phenylmethylsulfanyl)propanamide Openeye Name: 2-benzylsulfanyl-N-(1-isopropyl-2-methyl-propyl)propanamide CAS Name: N-(2,4-dimethylpentan-3-yl)-2-(phenylmethylthio)propanamide IUPAC Name: 2-benzylsulfanyl-N-(2,4-dimethylpentan-3-yl)propanamide Traditional Name: 2-(benzylthio)-N-(1-isopropyl-2-methyl-propyl)propionamide Formula: C17H27NOS MolecularWeight: 293.46738

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(C)C)NC(=O)C(C)SCC1=CC=CC=C1

Isomeric SMILES

CC(C)C(C(C)C)NC(=O)C(C)SCC1=CC=CC=C1

InChI

InChI=1S/C17H27NOS/c1-12(2)16(13(3)4)18-17(19)14(5)20-11-15-9-7-6-8-10-15/h6-10,12-14,16H,11H2,1-5H3,(H,18,19)