1-(1H-imidazol-5-ylmethyl)-4-methylsulfonyl-3-(phenylmethyl)-3,5-dihydro-2H-benzo[h][1,4]benzodiazepine

Systemtic Name: 1-(1H-imidazol-5-ylmethyl)-4-methylsulfonyl-3-(phenylmethyl)-3,5-dihydro-2H-benzo[h][1,4]benzodiazepine Openeye Name: 3-benzyl-1-(1H-imidazol-5-ylmethyl)-4-methylsulfonyl-3,5-dihydro-2H-benzo[h][1,4]benzodiazepine CAS Name: 1-(1H-imidazol-5-ylmethyl)-4-methylsulfonyl-3-(phenylmethyl)-3,5-dihydro-2H-benzo[h][1,4]benzodiazepine IUPAC Name: 3-benzyl-1-(1H-imidazol-5-ylmethyl)-4-methylsulfonyl-3,5-dihydro-2H-benzo[h][1,4]benzodiazepine Traditional Name: 3-benzyl-1-(1H-imidazol-5-ylmethyl)-4-mesyl-3,5-dihydro-2H-benzo[h][1,4]benzodiazepine Formula: C25H26N4O2S MolecularWeight: 446.56454

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CC2=CC3=CC=CC=C3C=C2N(CC1CC4=CC=CC=C4)CC5=CN=CN5

Isomeric SMILES

CS(=O)(=O)N1CC2=CC3=CC=CC=C3C=C2N(CC1CC4=CC=CC=C4)CC5=CN=CN5

InChI

InChI=1S/C25H26N4O2S/c1-32(30,31)29-15-22-12-20-9-5-6-10-21(20)13-25(22)28(16-23-14-26-18-27-23)17-24(29)11-19-7-3-2-4-8-19/h2-10,12-14,18,24H,11,15-17H2,1H3,(H,26,27)