N-[3-(azepan-1-yl)propyl]-2-[(4-methylphenyl)methylsulfanyl]ethanamide

Systemtic Name: N-[3-(azepan-1-yl)propyl]-2-[(4-methylphenyl)methylsulfanyl]ethanamide Openeye Name: N-[3-(azepan-1-yl)propyl]-2-(p-tolylmethylsulfanyl)acetamide CAS Name: N-[3-(1-azepanyl)propyl]-2-[(4-methylphenyl)methylthio]acetamide IUPAC Name: N-[3-(azepan-1-yl)propyl]-2-[(4-methylphenyl)methylsulfanyl]acetamide Traditional Name: N-[3-(azepan-1-yl)propyl]-2-[(4-methylbenzyl)thio]acetamide Formula: C19H30N2OS MolecularWeight: 334.5193

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSCC(=O)NCCCN2CCCCCC2

Isomeric SMILES

CC1=CC=C(C=C1)CSCC(=O)NCCCN2CCCCCC2

InChI

InChI=1S/C19H30N2OS/c1-17-7-9-18(10-8-17)15-23-16-19(22)20-11-6-14-21-12-4-2-3-5-13-21/h7-10H,2-6,11-16H2,1H3,(H,20,22)