3-(3-bromophenyl)-4-methyl-1H-1,2,4-triazol-5-one

Systemtic Name: 3-(3-bromophenyl)-4-methyl-1H-1,2,4-triazol-5-one Openeye Name: 3-(3-bromophenyl)-4-methyl-1H-1,2,4-triazol-5-one CAS Name: 3-(3-bromophenyl)-4-methyl-1H-1,2,4-triazol-5-one IUPAC Name: 3-(3-bromophenyl)-4-methyl-1H-1,2,4-triazol-5-one Traditional Name: 3-(3-bromophenyl)-4-methyl-1H-1,2,4-triazol-5-one Formula: C9H8BrN3O MolecularWeight: 254.08332

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NNC1=O)C2=CC(=CC=C2)Br

Isomeric SMILES

CN1C(=NNC1=O)C2=CC(=CC=C2)Br

InChI

InChI=1S/C9H8BrN3O/c1-13-8(11-12-9(13)14)6-3-2-4-7(10)5-6/h2-5H,1H3,(H,12,14)