6-bromanyl-2-methyl-3-[4-[4-(4-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]phenyl]quinazolin-4-one

Systemtic Name: 6-bromanyl-2-methyl-3-[4-[4-(4-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]phenyl]quinazolin-4-one Openeye Name: 6-bromo-2-methyl-3-[4-[4-(p-tolyl)-5-thioxo-1H-1,2,4-triazol-3-yl]phenyl]quinazolin-4-one CAS Name: 6-bromo-2-methyl-3-[4-[4-(4-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]phenyl]-4-quinazolinone IUPAC Name: 6-bromo-2-methyl-3-[4-[4-(4-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]phenyl]quinazolin-4-one Traditional Name: 6-bromo-2-methyl-3-[4-[4-(p-tolyl)-5-thioxo-1H-1,2,4-triazol-3-yl]phenyl]quinazolin-4-one Formula: C24H18BrN5OS MolecularWeight: 504.40162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NNC2=S)C3=CC=C(C=C3)N4C(=NC5=C(C4=O)C=C(C=C5)Br)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NNC2=S)C3=CC=C(C=C3)N4C(=NC5=C(C4=O)C=C(C=C5)Br)C

InChI

InChI=1S/C24H18BrN5OS/c1-14-3-8-19(9-4-14)30-22(27-28-24(30)32)16-5-10-18(11-6-16)29-15(2)26-21-12-7-17(25)13-20(21)23(29)31/h3-13H,1-2H3,(H,28,32)