7,7-dimethyl-4-phenyl-1,4-thiazepan-5-one

Systemtic Name: 7,7-dimethyl-4-phenyl-1,4-thiazepan-5-one Openeye Name: 7,7-dimethyl-4-phenyl-1,4-thiazepan-5-one CAS Name: 7,7-dimethyl-4-phenyl-1,4-thiazepan-5-one IUPAC Name: 7,7-dimethyl-4-phenyl-1,4-thiazepan-5-one Traditional Name: 7,7-dimethyl-4-phenyl-1,4-thiazepan-5-one Formula: C13H17NOS MolecularWeight: 235.34518

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)N(CCS1)C2=CC=CC=C2)C

Isomeric SMILES

CC1(CC(=O)N(CCS1)C2=CC=CC=C2)C

InChI

InChI=1S/C13H17NOS/c1-13(2)10-12(15)14(8-9-16-13)11-6-4-3-5-7-11/h3-7H,8-10H2,1-2H3