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

Systemtic Name: 7-cyano-N-methyl-3-(phenylmethyl)-N,1-bis(pyridin-3-ylmethyl)-3,5-dihydro-2H-1,4-benzodiazepine-4-sulfonamide Openeye Name: 3-benzyl-7-cyano-N-methyl-N,1-bis(3-pyridylmethyl)-3,5-dihydro-2H-1,4-benzodiazepine-4-sulfonamide CAS Name: 7-cyano-N-methyl-3-(phenylmethyl)-N,1-bis(3-pyridinylmethyl)-3,5-dihydro-2H-1,4-benzodiazepine-4-sulfonamide IUPAC Name: 3-benzyl-7-cyano-N-methyl-N,1-bis(pyridin-3-ylmethyl)-3,5-dihydro-2H-1,4-benzodiazepine-4-sulfonamide Traditional Name: 3-benzyl-7-cyano-N-methyl-N,1-bis(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=CN=CC=C1)S(=O)(=O)N2CC3=C(C=CC(=C3)C#N)N(CC2CC4=CC=CC=C4)CC5=CN=CC=C5

Isomeric SMILES

CN(CC1=CN=CC=C1)S(=O)(=O)N2CC3=C(C=CC(=C3)C#N)N(CC2CC4=CC=CC=C4)CC5=CN=CC=C5

InChI

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