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

Systemtic Name: 1-[1-(1H-imidazol-5-ylmethyl)-7-phenyl-3-(phenylmethyl)-3,5-dihydro-2H-1,4-benzodiazepin-4-yl]ethanone Openeye Name: 1-[3-benzyl-1-(1H-imidazol-5-ylmethyl)-7-phenyl-3,5-dihydro-2H-1,4-benzodiazepin-4-yl]ethanone CAS Name: 1-[1-(1H-imidazol-5-ylmethyl)-7-phenyl-3-(phenylmethyl)-3,5-dihydro-2H-1,4-benzodiazepin-4-yl]ethanone IUPAC Name: 1-[3-benzyl-1-(1H-imidazol-5-ylmethyl)-7-phenyl-3,5-dihydro-2H-1,4-benzodiazepin-4-yl]ethanone Traditional Name: 1-[3-benzyl-1-(1H-imidazol-5-ylmethyl)-7-phenyl-3,5-dihydro-2H-1,4-benzodiazepin-4-yl]ethanone Formula: C28H28N4O MolecularWeight: 436.54812

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CC2=C(C=CC(=C2)C3=CC=CC=C3)N(CC1CC4=CC=CC=C4)CC5=CN=CN5

Isomeric SMILES

CC(=O)N1CC2=C(C=CC(=C2)C3=CC=CC=C3)N(CC1CC4=CC=CC=C4)CC5=CN=CN5

InChI

InChI=1S/C28H28N4O/c1-21(33)32-17-25-15-24(23-10-6-3-7-11-23)12-13-28(25)31(18-26-16-29-20-30-26)19-27(32)14-22-8-4-2-5-9-22/h2-13,15-16,20,27H,14,17-19H2,1H3,(H,29,30)