2-(3-hexyl-4-oxidanylidene-quinazolin-2-yl)sulfanylethanamide

Systemtic Name: 2-(3-hexyl-4-oxidanylidene-quinazolin-2-yl)sulfanylethanamide Openeye Name: 2-(3-hexyl-4-oxo-quinazolin-2-yl)sulfanylacetamide CAS Name: 2-[(3-hexyl-4-oxo-2-quinazolinyl)thio]acetamide IUPAC Name: 2-(3-hexyl-4-oxoquinazolin-2-yl)sulfanylacetamide Traditional Name: 2-[(3-hexyl-4-keto-quinazolin-2-yl)thio]acetamide Formula: C16H21N3O2S MolecularWeight: 319.42184

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)N

Isomeric SMILES

CCCCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)N

InChI

InChI=1S/C16H21N3O2S/c1-2-3-4-7-10-19-15(21)12-8-5-6-9-13(12)18-16(19)22-11-14(17)20/h5-6,8-9H,2-4,7,10-11H2,1H3,(H2,17,20)