2-[4-oxidanylidene-3-(pyridin-2-ylmethyl)quinazolin-2-yl]sulfanylethanamide

Systemtic Name: 2-[4-oxidanylidene-3-(pyridin-2-ylmethyl)quinazolin-2-yl]sulfanylethanamide Openeye Name: 2-[4-oxo-3-(2-pyridylmethyl)quinazolin-2-yl]sulfanylacetamide CAS Name: 2-[[4-oxo-3-(2-pyridinylmethyl)-2-quinazolinyl]thio]acetamide IUPAC Name: 2-[4-oxo-3-(pyridin-2-ylmethyl)quinazolin-2-yl]sulfanylacetamide Traditional Name: 2-[[4-keto-3-(2-pyridylmethyl)quinazolin-2-yl]thio]acetamide Formula: C16H14N4O2S MolecularWeight: 326.37296

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCC(=O)N)CC3=CC=CC=N3

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCC(=O)N)CC3=CC=CC=N3

InChI

InChI=1S/C16H14N4O2S/c17-14(21)10-23-16-19-13-7-2-1-6-12(13)15(22)20(16)9-11-5-3-4-8-18-11/h1-8H,9-10H2,(H2,17,21)