N-(1,3-benzodioxol-5-yl)-2-(6-bromanyl-3-ethyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-2-(6-bromanyl-3-ethyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-ethanamide Openeye Name: N-(1,3-benzodioxol-5-yl)-2-(6-bromo-3-ethyl-4-oxo-quinazolin-2-yl)sulfanyl-acetamide CAS Name: N-(1,3-benzodioxol-5-yl)-2-[(6-bromo-3-ethyl-4-oxo-2-quinazolinyl)thio]acetamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-2-(6-bromo-3-ethyl-4-oxoquinazolin-2-yl)sulfanylacetamide Traditional Name: N-(1,3-benzodioxol-5-yl)-2-[(6-bromo-3-ethyl-4-keto-quinazolin-2-yl)thio]acetamide Formula: C19H16BrN3O4S MolecularWeight: 462.31704

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(C=CC(=C2)Br)N=C1SCC(=O)NC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCN1C(=O)C2=C(C=CC(=C2)Br)N=C1SCC(=O)NC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C19H16BrN3O4S/c1-2-23-18(25)13-7-11(20)3-5-14(13)22-19(23)28-9-17(24)21-12-4-6-15-16(8-12)27-10-26-15/h3-8H,2,9-10H2,1H3,(H,21,24)