1-bromanyl-4-methyl-6-pyridin-2-yl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine

Systemtic Name: 1-bromanyl-4-methyl-6-pyridin-2-yl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine Openeye Name: 1-bromo-4-methyl-6-(2-pyridyl)-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine CAS Name: 1-bromo-4-methyl-6-(2-pyridinyl)-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine IUPAC Name: 1-bromo-4-methyl-6-pyridin-2-yl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine Traditional Name: 1-bromo-4-methyl-6-(2-pyridyl)-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine Formula: C16H12BrN5 MolecularWeight: 354.20398

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2=NN=C(N2C3=CC=CC=C3C(=N1)C4=CC=CC=N4)Br

Isomeric SMILES

CC1C2=NN=C(N2C3=CC=CC=C3C(=N1)C4=CC=CC=N4)Br

InChI

InChI=1S/C16H12BrN5/c1-10-15-20-21-16(17)22(15)13-8-3-2-6-11(13)14(19-10)12-7-4-5-9-18-12/h2-10H,1H3