1-ethyl-6-pyrrolidin-1-yl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine

Systemtic Name: 1-ethyl-6-pyrrolidin-1-yl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine Openeye Name: 1-ethyl-6-pyrrolidin-1-yl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine CAS Name: 1-ethyl-6-(1-pyrrolidinyl)-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine IUPAC Name: 1-ethyl-6-pyrrolidin-1-yl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine Traditional Name: 1-ethyl-6-pyrrolidino-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine Formula: C16H19N5 MolecularWeight: 281.35556

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C2N1C3=CC=CC=C3C(=NC2)N4CCCC4

Isomeric SMILES

CCC1=NN=C2N1C3=CC=CC=C3C(=NC2)N4CCCC4

InChI

InChI=1S/C16H19N5/c1-2-14-18-19-15-11-17-16(20-9-5-6-10-20)12-7-3-4-8-13(12)21(14)15/h3-4,7-8H,2,5-6,9-11H2,1H3