2-[[6,8-bis(bromanyl)-4-oxidanylidene-1H-quinazolin-2-yl]sulfanyl]ethanoate

Systemtic Name: 2-[[6,8-bis(bromanyl)-4-oxidanylidene-1H-quinazolin-2-yl]sulfanyl]ethanoate Openeye Name: 2-[(6,8-dibromo-4-oxo-1H-quinazolin-2-yl)sulfanyl]acetate CAS Name: 2-[(6,8-dibromo-4-oxo-1H-quinazolin-2-yl)thio]acetate IUPAC Name: 2-[(6,8-dibromo-4-oxo-1H-quinazolin-2-yl)sulfanyl]acetate Traditional Name: 2-[(6,8-dibromo-4-keto-1H-quinazolin-2-yl)thio]acetate Formula: C10H5Br2N2O3S- MolecularWeight: 393.0313

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C2C(=C1Br)NC(=NC2=O)SCC(=O)[O-])Br

Isomeric SMILES

C1=C(C=C2C(=C1Br)NC(=NC2=O)SCC(=O)[O-])Br

InChI

InChI=1S/C10H6Br2N2O3S/c11-4-1-5-8(6(12)2-4)13-10(14-9(5)17)18-3-7(15)16/h1-2H,3H2,(H,15,16)(H,13,14,17)/p-1