1-[6-(4-bromophenyl)-2-methyl-5-phenyl-1,6-dihydro-1,2,4,5-tetrazin-3-yl]ethanone

Systemtic Name: 1-[6-(4-bromophenyl)-2-methyl-5-phenyl-1,6-dihydro-1,2,4,5-tetrazin-3-yl]ethanone Openeye Name: 1-[6-(4-bromophenyl)-2-methyl-5-phenyl-1,6-dihydro-1,2,4,5-tetrazin-3-yl]ethanone CAS Name: 1-[6-(4-bromophenyl)-2-methyl-5-phenyl-1,6-dihydro-1,2,4,5-tetrazin-3-yl]ethanone IUPAC Name: 1-[6-(4-bromophenyl)-2-methyl-5-phenyl-1,6-dihydro-1,2,4,5-tetrazin-3-yl]ethanone Traditional Name: 1-[6-(4-bromophenyl)-2-methyl-5-phenyl-1,6-dihydro-1,2,4,5-tetrazin-3-yl]ethanone Formula: C17H17BrN4O MolecularWeight: 373.24708

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=NN(C(NN1C)C2=CC=C(C=C2)Br)C3=CC=CC=C3

Isomeric SMILES

CC(=O)C1=NN(C(NN1C)C2=CC=C(C=C2)Br)C3=CC=CC=C3

InChI

InChI=1S/C17H17BrN4O/c1-12(23)16-20-22(15-6-4-3-5-7-15)17(19-21(16)2)13-8-10-14(18)11-9-13/h3-11,17,19H,1-2H3