8-chloranyl-1-(chloromethyl)-4-propyl-6-pyridin-2-yl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine

Systemtic Name: 8-chloranyl-1-(chloromethyl)-4-propyl-6-pyridin-2-yl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine Openeye Name: 8-chloro-1-(chloromethyl)-4-propyl-6-(2-pyridyl)-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine CAS Name: 8-chloro-1-(chloromethyl)-4-propyl-6-(2-pyridinyl)-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine IUPAC Name: 8-chloro-1-(chloromethyl)-4-propyl-6-pyridin-2-yl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine Traditional Name: 8-chloro-1-(chloromethyl)-4-propyl-6-(2-pyridyl)-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine Formula: C19H17Cl2N5 MolecularWeight: 386.27778

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1C2=NN=C(N2C3=C(C=C(C=C3)Cl)C(=N1)C4=CC=CC=N4)CCl

Isomeric SMILES

CCCC1C2=NN=C(N2C3=C(C=C(C=C3)Cl)C(=N1)C4=CC=CC=N4)CCl

InChI

InChI=1S/C19H17Cl2N5/c1-2-5-15-19-25-24-17(11-20)26(19)16-8-7-12(21)10-13(16)18(23-15)14-6-3-4-9-22-14/h3-4,6-10,15H,2,5,11H2,1H3