azepan-1-yl-(2-ethylsulfanylphenyl)methanone

Systemtic Name: azepan-1-yl-(2-ethylsulfanylphenyl)methanone Openeye Name: azepan-1-yl-(2-ethylsulfanylphenyl)methanone CAS Name: 1-azepanyl-[2-(ethylthio)phenyl]methanone IUPAC Name: azepan-1-yl-(2-ethylsulfanylphenyl)methanone Traditional Name: azepan-1-yl-[2-(ethylthio)phenyl]methanone Formula: C15H21NOS MolecularWeight: 263.39834

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC=CC=C1C(=O)N2CCCCCC2

Isomeric SMILES

CCSC1=CC=CC=C1C(=O)N2CCCCCC2

InChI

InChI=1S/C15H21NOS/c1-2-18-14-10-6-5-9-13(14)15(17)16-11-7-3-4-8-12-16/h5-6,9-10H,2-4,7-8,11-12H2,1H3