methyl N-[2-(4-bromophenyl)-3-oxidanylidene-1H-1,2,4-triazol-5-yl]carbamate

Systemtic Name: methyl N-[2-(4-bromophenyl)-3-oxidanylidene-1H-1,2,4-triazol-5-yl]carbamate Openeye Name: methyl N-[2-(4-bromophenyl)-3-oxo-1H-1,2,4-triazol-5-yl]carbamate CAS Name: N-[2-(4-bromophenyl)-3-oxo-1H-1,2,4-triazol-5-yl]carbamic acid methyl ester IUPAC Name: methyl N-[2-(4-bromophenyl)-3-oxo-1H-1,2,4-triazol-5-yl]carbamate Traditional Name: N-[2-(4-bromophenyl)-3-keto-1H-1,2,4-triazol-5-yl]carbamic acid methyl ester Formula: C10H9BrN4O3 MolecularWeight: 313.10746

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)NC1=NC(=O)N(N1)C2=CC=C(C=C2)Br

Isomeric SMILES

COC(=O)NC1=NC(=O)N(N1)C2=CC=C(C=C2)Br

InChI

InChI=1S/C10H9BrN4O3/c1-18-10(17)13-8-12-9(16)15(14-8)7-4-2-6(11)3-5-7/h2-5H,1H3,(H2,12,13,14,16,17)