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

Systemtic Name: 2-[7-bromanyl-1-(1H-imidazol-5-ylmethyl)-3-(phenylmethyl)-3,5-dihydro-2H-1,4-benzodiazepin-4-yl]ethanamide Openeye Name: 2-[3-benzyl-7-bromo-1-(1H-imidazol-5-ylmethyl)-3,5-dihydro-2H-1,4-benzodiazepin-4-yl]acetamide CAS Name: 2-[7-bromo-1-(1H-imidazol-5-ylmethyl)-3-(phenylmethyl)-3,5-dihydro-2H-1,4-benzodiazepin-4-yl]acetamide IUPAC Name: 2-[3-benzyl-7-bromo-1-(1H-imidazol-5-ylmethyl)-3,5-dihydro-2H-1,4-benzodiazepin-4-yl]acetamide Traditional Name: 2-[3-benzyl-7-bromo-1-(1H-imidazol-5-ylmethyl)-3,5-dihydro-2H-1,4-benzodiazepin-4-yl]acetamide Formula: C22H24BrN5O MolecularWeight: 454.36286

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(CC2=C(N1CC3=CN=CN3)C=CC(=C2)Br)CC(=O)N)CC4=CC=CC=C4

Isomeric SMILES

C1C(N(CC2=C(N1CC3=CN=CN3)C=CC(=C2)Br)CC(=O)N)CC4=CC=CC=C4

InChI

InChI=1S/C22H24BrN5O/c23-18-6-7-21-17(9-18)11-27(14-22(24)29)20(8-16-4-2-1-3-5-16)13-28(21)12-19-10-25-15-26-19/h1-7,9-10,15,20H,8,11-14H2,(H2,24,29)(H,25,26)