7-bromanyl-1-(1H-imidazol-5-ylmethyl)-N,N-dimethyl-3-(phenylmethyl)-3,5-dihydro-2H-1,4-benzodiazepine-4-sulfonamide

Systemtic Name: 7-bromanyl-1-(1H-imidazol-5-ylmethyl)-N,N-dimethyl-3-(phenylmethyl)-3,5-dihydro-2H-1,4-benzodiazepine-4-sulfonamide Openeye Name: 3-benzyl-7-bromo-1-(1H-imidazol-5-ylmethyl)-N,N-dimethyl-3,5-dihydro-2H-1,4-benzodiazepine-4-sulfonamide CAS Name: 7-bromo-1-(1H-imidazol-5-ylmethyl)-N,N-dimethyl-3-(phenylmethyl)-3,5-dihydro-2H-1,4-benzodiazepine-4-sulfonamide IUPAC Name: 3-benzyl-7-bromo-1-(1H-imidazol-5-ylmethyl)-N,N-dimethyl-3,5-dihydro-2H-1,4-benzodiazepine-4-sulfonamide Traditional Name: 3-benzyl-7-bromo-1-(1H-imidazol-5-ylmethyl)-N,N-dimethyl-3,5-dihydro-2H-1,4-benzodiazepine-4-sulfonamide Formula: C22H26BrN5O2S MolecularWeight: 504.44314

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)N1CC2=C(C=CC(=C2)Br)N(CC1CC3=CC=CC=C3)CC4=CN=CN4

Isomeric SMILES

CN(C)S(=O)(=O)N1CC2=C(C=CC(=C2)Br)N(CC1CC3=CC=CC=C3)CC4=CN=CN4

InChI

InChI=1S/C22H26BrN5O2S/c1-26(2)31(29,30)28-13-18-11-19(23)8-9-22(18)27(14-20-12-24-16-25-20)15-21(28)10-17-6-4-3-5-7-17/h3-9,11-12,16,21H,10,13-15H2,1-2H3,(H,24,25)