2-[6,8-bis(bromanyl)-3-ethyl-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoate

Systemtic Name: 2-[6,8-bis(bromanyl)-3-ethyl-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoate Openeye Name: 2-(6,8-dibromo-3-ethyl-4-oxo-quinazolin-2-yl)sulfanylacetate CAS Name: 2-[(6,8-dibromo-3-ethyl-4-oxo-2-quinazolinyl)thio]acetate IUPAC Name: 2-(6,8-dibromo-3-ethyl-4-oxoquinazolin-2-yl)sulfanylacetate Traditional Name: 2-[(6,8-dibromo-3-ethyl-4-keto-quinazolin-2-yl)thio]acetate Formula: C12H9Br2N2O3S- MolecularWeight: 421.08446

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC(=CC(=C2N=C1SCC(=O)[O-])Br)Br

Isomeric SMILES

CCN1C(=O)C2=CC(=CC(=C2N=C1SCC(=O)[O-])Br)Br

InChI

InChI=1S/C12H10Br2N2O3S/c1-2-16-11(19)7-3-6(13)4-8(14)10(7)15-12(16)20-5-9(17)18/h3-4H,2,5H2,1H3,(H,17,18)/p-1