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

Systemtic Name: 2-[6,8-bis(bromanyl)-4-oxidanylidene-3-phenyl-quinazolin-2-yl]sulfanylethanoate Openeye Name: 2-(6,8-dibromo-4-oxo-3-phenyl-quinazolin-2-yl)sulfanylacetate CAS Name: 2-[(6,8-dibromo-4-oxo-3-phenyl-2-quinazolinyl)thio]acetate IUPAC Name: 2-(6,8-dibromo-4-oxo-3-phenylquinazolin-2-yl)sulfanylacetate Traditional Name: 2-[(6,8-dibromo-4-keto-3-phenyl-quinazolin-2-yl)thio]acetate Formula: C16H9Br2N2O3S- MolecularWeight: 469.12726

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C3=CC(=CC(=C3N=C2SCC(=O)[O-])Br)Br

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)C3=CC(=CC(=C3N=C2SCC(=O)[O-])Br)Br

InChI

InChI=1S/C16H10Br2N2O3S/c17-9-6-11-14(12(18)7-9)19-16(24-8-13(21)22)20(15(11)23)10-4-2-1-3-5-10/h1-7H,8H2,(H,21,22)/p-1