N-(1,3-benzodioxol-5-yl)-2-(4-oxidanylidene-3-prop-2-enyl-benzo[g]quinazolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-2-(4-oxidanylidene-3-prop-2-enyl-benzo[g]quinazolin-2-yl)sulfanyl-ethanamide Openeye Name: 2-(3-allyl-4-oxo-benzo[g]quinazolin-2-yl)sulfanyl-N-(1,3-benzodioxol-5-yl)acetamide CAS Name: N-(1,3-benzodioxol-5-yl)-2-[(4-oxo-3-prop-2-enyl-2-benzo[g]quinazolinyl)thio]acetamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-2-(4-oxo-3-prop-2-enylbenzo[g]quinazolin-2-yl)sulfanylacetamide Traditional Name: 2-[(3-allyl-4-keto-benzo[g]quinazolin-2-yl)thio]-N-(1,3-benzodioxol-5-yl)acetamide Formula: C24H19N3O4S MolecularWeight: 445.49036

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=CC3=CC=CC=C3C=C2N=C1SCC(=O)NC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C=CCN1C(=O)C2=CC3=CC=CC=C3C=C2N=C1SCC(=O)NC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C24H19N3O4S/c1-2-9-27-23(29)18-10-15-5-3-4-6-16(15)11-19(18)26-24(27)32-13-22(28)25-17-7-8-20-21(12-17)31-14-30-20/h2-8,10-12H,1,9,13-14H2,(H,25,28)