[1-(1H-imidazol-5-ylmethyl)-7-phenyl-3,5-dihydro-2H-1,4-benzodiazepin-4-yl]-phenyl-methanone dihydrochloride

Systemtic Name: [1-(1H-imidazol-5-ylmethyl)-7-phenyl-3,5-dihydro-2H-1,4-benzodiazepin-4-yl]-phenyl-methanone dihydrochloride Openeye Name: [1-(1H-imidazol-5-ylmethyl)-7-phenyl-3,5-dihydro-2H-1,4-benzodiazepin-4-yl]-phenyl-methanone dihydrochloride CAS Name: [1-(1H-imidazol-5-ylmethyl)-7-phenyl-3,5-dihydro-2H-1,4-benzodiazepin-4-yl]-phenylmethanone dihydrochloride IUPAC Name: [1-(1H-imidazol-5-ylmethyl)-7-phenyl-3,5-dihydro-2H-1,4-benzodiazepin-4-yl]-phenylmethanone dihydrochloride Traditional Name: [1-(1H-imidazol-5-ylmethyl)-7-phenyl-3,5-dihydro-2H-1,4-benzodiazepin-4-yl]-phenyl-methanone dihydrochloride Formula: C26H26Cl2N4O MolecularWeight: 481.41684

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=C(CN1C(=O)C3=CC=CC=C3)C=C(C=C2)C4=CC=CC=C4)CC5=CN=CN5.Cl.Cl

Isomeric SMILES

C1CN(C2=C(CN1C(=O)C3=CC=CC=C3)C=C(C=C2)C4=CC=CC=C4)CC5=CN=CN5.Cl.Cl

InChI

InChI=1S/C26H24N4O.2ClH/c31-26(21-9-5-2-6-10-21)30-14-13-29(18-24-16-27-19-28-24)25-12-11-22(15-23(25)17-30)20-7-3-1-4-8-20;;/h1-12,15-16,19H,13-14,17-18H2,(H,27,28);2*1H