2-ethanoyl-3-oxidanylidene-N-phenyl-hexanethioamide

Systemtic Name: 2-ethanoyl-3-oxidanylidene-N-phenyl-hexanethioamide Openeye Name: 2-acetyl-3-oxo-N-phenyl-hexanethioamide CAS Name: 2-acetyl-3-oxo-N-phenylhexanethioamide IUPAC Name: 2-acetyl-3-oxo-N-phenylhexanethioamide Traditional Name: 2-acetyl-3-keto-N-phenyl-hexanethioamide Formula: C14H17NO2S MolecularWeight: 263.35528

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C(C(=O)C)C(=S)NC1=CC=CC=C1

Isomeric SMILES

CCCC(=O)C(C(=O)C)C(=S)NC1=CC=CC=C1

InChI

InChI=1S/C14H17NO2S/c1-3-7-12(17)13(10(2)16)14(18)15-11-8-5-4-6-9-11/h4-6,8-9,13H,3,7H2,1-2H3,(H,15,18)