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

Systemtic Name: 1-[7-bromanyl-1-(1H-imidazol-5-ylmethyl)-3-(naphthalen-1-ylmethyl)-3,5-dihydro-2H-1,4-benzodiazepin-4-yl]ethanone Openeye Name: 1-[7-bromo-1-(1H-imidazol-5-ylmethyl)-3-(1-naphthylmethyl)-3,5-dihydro-2H-1,4-benzodiazepin-4-yl]ethanone CAS Name: 1-[7-bromo-1-(1H-imidazol-5-ylmethyl)-3-(1-naphthalenylmethyl)-3,5-dihydro-2H-1,4-benzodiazepin-4-yl]ethanone IUPAC Name: 1-[7-bromo-1-(1H-imidazol-5-ylmethyl)-3-(naphthalen-1-ylmethyl)-3,5-dihydro-2H-1,4-benzodiazepin-4-yl]ethanone Traditional Name: 1-[7-bromo-1-(1H-imidazol-5-ylmethyl)-3-(1-naphthylmethyl)-3,5-dihydro-2H-1,4-benzodiazepin-4-yl]ethanone Formula: C26H25BrN4O MolecularWeight: 489.4069

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CC2=C(C=CC(=C2)Br)N(CC1CC3=CC=CC4=CC=CC=C43)CC5=CN=CN5

Isomeric SMILES

CC(=O)N1CC2=C(C=CC(=C2)Br)N(CC1CC3=CC=CC4=CC=CC=C43)CC5=CN=CN5

InChI

InChI=1S/C26H25BrN4O/c1-18(32)31-14-21-11-22(27)9-10-26(21)30(15-23-13-28-17-29-23)16-24(31)12-20-7-4-6-19-5-2-3-8-25(19)20/h2-11,13,17,24H,12,14-16H2,1H3,(H,28,29)