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

Systemtic Name: 3H-benzimidazol-5-yl-[1-(1H-imidazol-5-ylmethyl)-7-phenyl-3,5-dihydro-2H-1,4-benzodiazepin-4-yl]methanone Openeye Name: 3H-benzimidazol-5-yl-[1-(1H-imidazol-5-ylmethyl)-7-phenyl-3,5-dihydro-2H-1,4-benzodiazepin-4-yl]methanone CAS Name: 3H-benzimidazol-5-yl-[1-(1H-imidazol-5-ylmethyl)-7-phenyl-3,5-dihydro-2H-1,4-benzodiazepin-4-yl]methanone IUPAC Name: 3H-benzimidazol-5-yl-[1-(1H-imidazol-5-ylmethyl)-7-phenyl-3,5-dihydro-2H-1,4-benzodiazepin-4-yl]methanone Traditional Name: 3H-benzimidazol-5-yl-[1-(1H-imidazol-5-ylmethyl)-7-phenyl-3,5-dihydro-2H-1,4-benzodiazepin-4-yl]methanone Formula: C27H24N6O MolecularWeight: 448.51906

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=C(CN1C(=O)C3=CC4=C(C=C3)N=CN4)C=C(C=C2)C5=CC=CC=C5)CC6=CN=CN6

Isomeric SMILES

C1CN(C2=C(CN1C(=O)C3=CC4=C(C=C3)N=CN4)C=C(C=C2)C5=CC=CC=C5)CC6=CN=CN6

InChI

InChI=1S/C27H24N6O/c34-27(21-6-8-24-25(13-21)31-18-30-24)33-11-10-32(16-23-14-28-17-29-23)26-9-7-20(12-22(26)15-33)19-4-2-1-3-5-19/h1-9,12-14,17-18H,10-11,15-16H2,(H,28,29)(H,30,31)