6,8-bis(bromanyl)-2-[(2-methyl-5-oxidanylidene-1H-1,2,4-triazol-3-yl)sulfanylmethyl]-1H-quinazolin-4-one

Systemtic Name: 6,8-bis(bromanyl)-2-[(2-methyl-5-oxidanylidene-1H-1,2,4-triazol-3-yl)sulfanylmethyl]-1H-quinazolin-4-one Openeye Name: 6,8-dibromo-2-[(2-methyl-5-oxo-1H-1,2,4-triazol-3-yl)sulfanylmethyl]-1H-quinazolin-4-one CAS Name: 6,8-dibromo-2-[[(2-methyl-5-oxo-1H-1,2,4-triazol-3-yl)thio]methyl]-1H-quinazolin-4-one IUPAC Name: 6,8-dibromo-2-[(2-methyl-5-oxo-1H-1,2,4-triazol-3-yl)sulfanylmethyl]-1H-quinazolin-4-one Traditional Name: 6,8-dibromo-2-[[(5-keto-2-methyl-1H-1,2,4-triazol-3-yl)thio]methyl]-1H-quinazolin-4-one Formula: C12H9Br2N5O2S MolecularWeight: 447.10516

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NC(=O)N1)SCC2=NC(=O)C3=CC(=CC(=C3N2)Br)Br

Isomeric SMILES

CN1C(=NC(=O)N1)SCC2=NC(=O)C3=CC(=CC(=C3N2)Br)Br

InChI

InChI=1S/C12H9Br2N5O2S/c1-19-12(17-11(21)18-19)22-4-8-15-9-6(10(20)16-8)2-5(13)3-7(9)14/h2-3H,4H2,1H3,(H,18,21)(H,15,16,20)