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

Systemtic Name: 7-cyano-1-(1H-imidazol-5-ylmethyl)-N,N-dimethyl-3-(pyridin-3-ylmethyl)-3,5-dihydro-2H-1,4-benzodiazepine-4-sulfonamide Openeye Name: 7-cyano-1-(1H-imidazol-5-ylmethyl)-N,N-dimethyl-3-(3-pyridylmethyl)-3,5-dihydro-2H-1,4-benzodiazepine-4-sulfonamide CAS Name: 7-cyano-1-(1H-imidazol-5-ylmethyl)-N,N-dimethyl-3-(3-pyridinylmethyl)-3,5-dihydro-2H-1,4-benzodiazepine-4-sulfonamide IUPAC Name: 7-cyano-1-(1H-imidazol-5-ylmethyl)-N,N-dimethyl-3-(pyridin-3-ylmethyl)-3,5-dihydro-2H-1,4-benzodiazepine-4-sulfonamide Traditional Name: 7-cyano-1-(1H-imidazol-5-ylmethyl)-N,N-dimethyl-3-(3-pyridylmethyl)-3,5-dihydro-2H-1,4-benzodiazepine-4-sulfonamide Formula: C22H25N7O2S MolecularWeight: 451.5446

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25N7O2S/c1-27(2)32(30,31)29-13-19-8-17(10-23)5-6-22(19)28(14-20-12-25-16-26-20)15-21(29)9-18-4-3-7-24-11-18/h3-8,11-12,16,21H,9,13-15H2,1-2H3,(H,25,26)