2-azanyl-4-[(4-bromophenyl)methyl]-1,2,4-triazol-3-one

Systemtic Name: 2-azanyl-4-[(4-bromophenyl)methyl]-1,2,4-triazol-3-one Openeye Name: 2-amino-4-[(4-bromophenyl)methyl]-1,2,4-triazol-3-one CAS Name: 2-amino-4-[(4-bromophenyl)methyl]-1,2,4-triazol-3-one IUPAC Name: 2-amino-4-[(4-bromophenyl)methyl]-1,2,4-triazol-3-one Traditional Name: 2-amino-4-(4-bromobenzyl)-1,2,4-triazol-3-one Formula: C9H9BrN4O MolecularWeight: 269.09796

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CN2C=NN(C2=O)N)Br

Isomeric SMILES

C1=CC(=CC=C1CN2C=NN(C2=O)N)Br

InChI

InChI=1S/C9H9BrN4O/c10-8-3-1-7(2-4-8)5-13-6-12-14(11)9(13)15/h1-4,6H,5,11H2