(3R)-7-cyano-N-methyl-3-(phenylmethyl)-N-(pyridin-2-ylmethyl)-1-(pyridin-3-ylmethyl)-3,5-dihydro-2H-1,4-benzodiazepine-4-sulfonamide

Systemtic Name: (3R)-7-cyano-N-methyl-3-(phenylmethyl)-N-(pyridin-2-ylmethyl)-1-(pyridin-3-ylmethyl)-3,5-dihydro-2H-1,4-benzodiazepine-4-sulfonamide Openeye Name: (3R)-3-benzyl-7-cyano-N-methyl-N-(2-pyridylmethyl)-1-(3-pyridylmethyl)-3,5-dihydro-2H-1,4-benzodiazepine-4-sulfonamide CAS Name: (3R)-7-cyano-N-methyl-3-(phenylmethyl)-N-(2-pyridinylmethyl)-1-(3-pyridinylmethyl)-3,5-dihydro-2H-1,4-benzodiazepine-4-sulfonamide IUPAC Name: (3R)-3-benzyl-7-cyano-N-methyl-N-(pyridin-2-ylmethyl)-1-(pyridin-3-ylmethyl)-3,5-dihydro-2H-1,4-benzodiazepine-4-sulfonamide Traditional Name: (3R)-3-benzyl-7-cyano-N-methyl-N-(2-pyridylmethyl)-1-(3-pyridylmethyl)-3,5-dihydro-2H-1,4-benzodiazepine-4-sulfonamide Formula: C30H30N6O2S MolecularWeight: 538.6632

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=N1)S(=O)(=O)N2CC3=C(C=CC(=C3)C#N)N(CC2CC4=CC=CC=C4)CC5=CN=CC=C5

Isomeric SMILES

CN(CC1=CC=CC=N1)S(=O)(=O)N2CC3=C(C=CC(=C3)C#N)N(C[C@H]2CC4=CC=CC=C4)CC5=CN=CC=C5

InChI

InChI=1S/C30H30N6O2S/c1-34(22-28-11-5-6-15-33-28)39(37,38)36-21-27-16-25(18-31)12-13-30(27)35(20-26-10-7-14-32-19-26)23-29(36)17-24-8-3-2-4-9-24/h2-16,19,29H,17,20-23H2,1H3/t29-/m1/s1