3-(3-oxidanylidene-2,4-dihydroquinoxalin-1-yl)pentanethioamide

Systemtic Name: 3-(3-oxidanylidene-2,4-dihydroquinoxalin-1-yl)pentanethioamide Openeye Name: 3-(3-oxo-2,4-dihydroquinoxalin-1-yl)pentanethioamide CAS Name: 3-(3-oxo-2,4-dihydroquinoxalin-1-yl)pentanethioamide IUPAC Name: 3-(3-oxo-2,4-dihydroquinoxalin-1-yl)pentanethioamide Traditional Name: 3-(3-keto-2,4-dihydroquinoxalin-1-yl)thiovaleramide Formula: C13H17N3OS MolecularWeight: 263.35858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(=S)N)N1CC(=O)NC2=CC=CC=C21

Isomeric SMILES

CCC(CC(=S)N)N1CC(=O)NC2=CC=CC=C21

InChI

InChI=1S/C13H17N3OS/c1-2-9(7-12(14)18)16-8-13(17)15-10-5-3-4-6-11(10)16/h3-6,9H,2,7-8H2,1H3,(H2,14,18)(H,15,17)