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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NNC(=O)N1C2=CC=C(C=C2)Br

Isomeric SMILES

CC1=NNC(=O)N1C2=CC=C(C=C2)Br

InChI

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