2-(5-azanylidene-3,4-dimethyl-1,2,4-triazol-1-yl)-1-(4-bromophenyl)ethanone

Systemtic Name: 2-(5-azanylidene-3,4-dimethyl-1,2,4-triazol-1-yl)-1-(4-bromophenyl)ethanone Openeye Name: 1-(4-bromophenyl)-2-(5-imino-3,4-dimethyl-1,2,4-triazol-1-yl)ethanone CAS Name: 1-(4-bromophenyl)-2-(5-imino-3,4-dimethyl-1,2,4-triazol-1-yl)ethanone IUPAC Name: 1-(4-bromophenyl)-2-(5-imino-3,4-dimethyl-1,2,4-triazol-1-yl)ethanone Traditional Name: 1-(4-bromophenyl)-2-(5-imino-3,4-dimethyl-1,2,4-triazol-1-yl)ethanone Formula: C12H13BrN4O MolecularWeight: 309.16182

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=N)N1C)CC(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CC1=NN(C(=N)N1C)CC(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C12H13BrN4O/c1-8-15-17(12(14)16(8)2)7-11(18)9-3-5-10(13)6-4-9/h3-6,14H,7H2,1-2H3