3-[(4-phenyl-1,3-thiazol-2-yl)sulfanyl]azepan-2-one

Systemtic Name: 3-[(4-phenyl-1,3-thiazol-2-yl)sulfanyl]azepan-2-one Openeye Name: 3-(4-phenylthiazol-2-yl)sulfanylazepan-2-one CAS Name: 3-[(4-phenyl-2-thiazolyl)thio]-2-azepanone IUPAC Name: 3-[(4-phenyl-1,3-thiazol-2-yl)sulfanyl]azepan-2-one Traditional Name: 3-[(4-phenylthiazol-2-yl)thio]azepan-2-one Formula: C15H16N2OS2 MolecularWeight: 304.43034

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)SC2=NC(=CS2)C3=CC=CC=C3

Isomeric SMILES

C1CCNC(=O)C(C1)SC2=NC(=CS2)C3=CC=CC=C3

InChI

InChI=1S/C15H16N2OS2/c18-14-13(8-4-5-9-16-14)20-15-17-12(10-19-15)11-6-2-1-3-7-11/h1-3,6-7,10,13H,4-5,8-9H2,(H,16,18)