8-bromanyl-1-ethyl-6-piperidin-1-yl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine

Systemtic Name: 8-bromanyl-1-ethyl-6-piperidin-1-yl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine Openeye Name: 8-bromo-1-ethyl-6-(1-piperidyl)-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine CAS Name: 8-bromo-1-ethyl-6-(1-piperidinyl)-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine IUPAC Name: 8-bromo-1-ethyl-6-piperidin-1-yl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine Traditional Name: 8-bromo-1-ethyl-6-piperidino-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine Formula: C17H20BrN5 MolecularWeight: 374.2782

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C2N1C3=C(C=C(C=C3)Br)C(=NC2)N4CCCCC4

Isomeric SMILES

CCC1=NN=C2N1C3=C(C=C(C=C3)Br)C(=NC2)N4CCCCC4

InChI

InChI=1S/C17H20BrN5/c1-2-15-20-21-16-11-19-17(22-8-4-3-5-9-22)13-10-12(18)6-7-14(13)23(15)16/h6-7,10H,2-5,8-9,11H2,1H3