N-(3-ethanoylphenyl)azepane-1-carbothioamide

Systemtic Name: N-(3-ethanoylphenyl)azepane-1-carbothioamide Openeye Name: N-(3-acetylphenyl)azepane-1-carbothioamide CAS Name: N-(3-acetylphenyl)-1-azepanecarbothioamide IUPAC Name: N-(3-acetylphenyl)azepane-1-carbothioamide Traditional Name: N-(3-acetylphenyl)azepane-1-carbothioamide Formula: C15H20N2OS MolecularWeight: 276.3971

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)NC(=S)N2CCCCCC2

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)NC(=S)N2CCCCCC2

InChI

InChI=1S/C15H20N2OS/c1-12(18)13-7-6-8-14(11-13)16-15(19)17-9-4-2-3-5-10-17/h6-8,11H,2-5,9-10H2,1H3,(H,16,19)