6,8-bis(bromanyl)-2-methyl-3-(6-methyl-5-oxidanylidene-3-sulfanylidene-2H-1,2,4-triazin-4-yl)quinazolin-4-one

Systemtic Name: 6,8-bis(bromanyl)-2-methyl-3-(6-methyl-5-oxidanylidene-3-sulfanylidene-2H-1,2,4-triazin-4-yl)quinazolin-4-one Openeye Name: 6,8-dibromo-2-methyl-3-(6-methyl-5-oxo-3-thioxo-2H-1,2,4-triazin-4-yl)quinazolin-4-one CAS Name: 6,8-dibromo-2-methyl-3-(6-methyl-5-oxo-3-sulfanylidene-2H-1,2,4-triazin-4-yl)-4-quinazolinone IUPAC Name: 6,8-dibromo-2-methyl-3-(6-methyl-5-oxo-3-sulfanylidene-2H-1,2,4-triazin-4-yl)quinazolin-4-one Traditional Name: 6,8-dibromo-3-(5-keto-6-methyl-3-thioxo-2H-1,2,4-triazin-4-yl)-2-methyl-quinazolin-4-one Formula: C13H9Br2N5O2S MolecularWeight: 459.11586

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NNC(=S)N(C1=O)N2C(=NC3=C(C=C(C=C3C2=O)Br)Br)C

Isomeric SMILES

CC1=NNC(=S)N(C1=O)N2C(=NC3=C(C=C(C=C3C2=O)Br)Br)C

InChI

InChI=1S/C13H9Br2N5O2S/c1-5-11(21)20(13(23)18-17-5)19-6(2)16-10-8(12(19)22)3-7(14)4-9(10)15/h3-4H,1-2H3,(H,18,23)