3-(4-bromophenyl)-5-methyl-1H-[1,2,4]triazolo[4,3-a]pyrimidin-7-one

Systemtic Name: 3-(4-bromophenyl)-5-methyl-1H-[1,2,4]triazolo[4,3-a]pyrimidin-7-one Openeye Name: 3-(4-bromophenyl)-5-methyl-1H-[1,2,4]triazolo[4,3-a]pyrimidin-7-one CAS Name: 3-(4-bromophenyl)-5-methyl-1H-[1,2,4]triazolo[4,3-a]pyrimidin-7-one IUPAC Name: 3-(4-bromophenyl)-5-methyl-1H-[1,2,4]triazolo[4,3-a]pyrimidin-7-one Traditional Name: 3-(4-bromophenyl)-5-methyl-1H-[1,2,4]triazolo[4,3-a]pyrimidin-7-one Formula: C12H9BrN4O MolecularWeight: 305.13006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N=C2N1C(=NN2)C3=CC=C(C=C3)Br

Isomeric SMILES

CC1=CC(=O)N=C2N1C(=NN2)C3=CC=C(C=C3)Br

InChI

InChI=1S/C12H9BrN4O/c1-7-6-10(18)14-12-16-15-11(17(7)12)8-2-4-9(13)5-3-8/h2-6H,1H3,(H,14,16,18)