N-(2-oxidanylideneazepan-3-yl)-2-phenylsulfanyl-propanamide

Systemtic Name: N-(2-oxidanylideneazepan-3-yl)-2-phenylsulfanyl-propanamide Openeye Name: N-(2-oxoazepan-3-yl)-2-phenylsulfanyl-propanamide CAS Name: N-(2-oxo-3-azepanyl)-2-(phenylthio)propanamide IUPAC Name: N-(2-oxoazepan-3-yl)-2-phenylsulfanylpropanamide Traditional Name: N-(2-ketoazepan-3-yl)-2-(phenylthio)propionamide Formula: C15H20N2O2S MolecularWeight: 292.3965

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCCCNC1=O)SC2=CC=CC=C2

Isomeric SMILES

CC(C(=O)NC1CCCCNC1=O)SC2=CC=CC=C2

InChI

InChI=1S/C15H20N2O2S/c1-11(20-12-7-3-2-4-8-12)14(18)17-13-9-5-6-10-16-15(13)19/h2-4,7-8,11,13H,5-6,9-10H2,1H3,(H,16,19)(H,17,18)