6-piperidin-1-yl-1-propan-2-yl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine

Systemtic Name: 6-piperidin-1-yl-1-propan-2-yl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine Openeye Name: 1-isopropyl-6-(1-piperidyl)-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine CAS Name: 6-(1-piperidinyl)-1-propan-2-yl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine IUPAC Name: 6-piperidin-1-yl-1-propan-2-yl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine Traditional Name: 1-isopropyl-6-piperidino-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine Formula: C18H23N5 MolecularWeight: 309.40872

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN=C2N1C3=CC=CC=C3C(=NC2)N4CCCCC4

Isomeric SMILES

CC(C)C1=NN=C2N1C3=CC=CC=C3C(=NC2)N4CCCCC4

InChI

InChI=1S/C18H23N5/c1-13(2)17-21-20-16-12-19-18(22-10-6-3-7-11-22)14-8-4-5-9-15(14)23(16)17/h4-5,8-9,13H,3,6-7,10-12H2,1-2H3