1-(1H-imidazol-5-ylmethyl)-4-methylsulfonyl-7-phenyl-3-(phenylmethyl)-3,5-dihydro-2H-1,4-benzodiazepine

Systemtic Name: 1-(1H-imidazol-5-ylmethyl)-4-methylsulfonyl-7-phenyl-3-(phenylmethyl)-3,5-dihydro-2H-1,4-benzodiazepine Openeye Name: 3-benzyl-1-(1H-imidazol-5-ylmethyl)-4-methylsulfonyl-7-phenyl-3,5-dihydro-2H-1,4-benzodiazepine CAS Name: 1-(1H-imidazol-5-ylmethyl)-4-methylsulfonyl-7-phenyl-3-(phenylmethyl)-3,5-dihydro-2H-1,4-benzodiazepine IUPAC Name: 3-benzyl-1-(1H-imidazol-5-ylmethyl)-4-methylsulfonyl-7-phenyl-3,5-dihydro-2H-1,4-benzodiazepine Traditional Name: 3-benzyl-1-(1H-imidazol-5-ylmethyl)-4-mesyl-7-phenyl-3,5-dihydro-2H-1,4-benzodiazepine Formula: C27H28N4O2S MolecularWeight: 472.60182

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H28N4O2S/c1-34(32,33)31-17-24-15-23(22-10-6-3-7-11-22)12-13-27(24)30(18-25-16-28-20-29-25)19-26(31)14-21-8-4-2-5-9-21/h2-13,15-16,20,26H,14,17-19H2,1H3,(H,28,29)