3-methyl-2-phenyl-4-pyridin-2-yl-4,5-dihydro-1,3-benzodiazepine hydrate dihydrochloride

Systemtic Name: 3-methyl-2-phenyl-4-pyridin-2-yl-4,5-dihydro-1,3-benzodiazepine hydrate dihydrochloride Openeye Name: 3-methyl-2-phenyl-4-(2-pyridyl)-4,5-dihydro-1,3-benzodiazepine hydrate dihydrochloride CAS Name: 3-methyl-2-phenyl-4-(2-pyridinyl)-4,5-dihydro-1,3-benzodiazepine hydrate dihydrochloride IUPAC Name: 3-methyl-2-phenyl-4-pyridin-2-yl-4,5-dihydro-1,3-benzodiazepine hydrate dihydrochloride Traditional Name: 3-methyl-2-phenyl-4-(2-pyridyl)-4,5-dihydro-1,3-benzodiazepine hydrate dihydrochloride Formula: C21H23Cl2N3O MolecularWeight: 404.33282

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(CC2=CC=CC=C2N=C1C3=CC=CC=C3)C4=CC=CC=N4.O.Cl.Cl

Isomeric SMILES

CN1C(CC2=CC=CC=C2N=C1C3=CC=CC=C3)C4=CC=CC=N4.O.Cl.Cl

InChI

InChI=1S/C21H19N3.2ClH.H2O/c1-24-20(19-13-7-8-14-22-19)15-17-11-5-6-12-18(17)23-21(24)16-9-3-2-4-10-16;;;/h2-14,20H,15H2,1H3;2*1H;1H2