N-[2-(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanylethanoyl]benzamide

Systemtic Name: N-[2-(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanylethanoyl]benzamide Openeye Name: N-[2-(3-allyl-4-oxo-quinazolin-2-yl)sulfanylacetyl]benzamide CAS Name: N-[1-oxo-2-[(4-oxo-3-prop-2-enyl-2-quinazolinyl)thio]ethyl]benzamide IUPAC Name: N-[2-(4-oxo-3-prop-2-enylquinazolin-2-yl)sulfanylacetyl]benzamide Traditional Name: N-[2-[(3-allyl-4-keto-quinazolin-2-yl)thio]acetyl]benzamide Formula: C20H17N3O3S MolecularWeight: 379.43228

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC(=O)C3=CC=CC=C3

Isomeric SMILES

C=CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H17N3O3S/c1-2-12-23-19(26)15-10-6-7-11-16(15)21-20(23)27-13-17(24)22-18(25)14-8-4-3-5-9-14/h2-11H,1,12-13H2,(H,22,24,25)