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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSCC(=O)NCCCN2CCCCCC2

Isomeric SMILES

CC1=CC=CC=C1CSCC(=O)NCCCN2CCCCCC2

InChI

InChI=1S/C19H30N2OS/c1-17-9-4-5-10-18(17)15-23-16-19(22)20-11-8-14-21-12-6-2-3-7-13-21/h4-5,9-10H,2-3,6-8,11-16H2,1H3,(H,20,22)