2-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]sulfanyl-N-(4-chlorophenyl)ethanamide

Systemtic Name: 2-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]sulfanyl-N-(4-chlorophenyl)ethanamide Openeye Name: 2-[2-(azepan-1-yl)-2-oxo-ethyl]sulfanyl-N-(4-chlorophenyl)acetamide CAS Name: 2-[[2-(1-azepanyl)-2-oxoethyl]thio]-N-(4-chlorophenyl)acetamide IUPAC Name: 2-[2-(azepan-1-yl)-2-oxoethyl]sulfanyl-N-(4-chlorophenyl)acetamide Traditional Name: 2-[[2-(azepan-1-yl)-2-keto-ethyl]thio]-N-(4-chlorophenyl)acetamide Formula: C16H21ClN2O2S MolecularWeight: 340.86814

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CSCC(=O)NC2=CC=C(C=C2)Cl

Isomeric SMILES

C1CCCN(CC1)C(=O)CSCC(=O)NC2=CC=C(C=C2)Cl

InChI

InChI=1S/C16H21ClN2O2S/c17-13-5-7-14(8-6-13)18-15(20)11-22-12-16(21)19-9-3-1-2-4-10-19/h5-8H,1-4,9-12H2,(H,18,20)