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

Systemtic Name: 7-cyano-N-(2-methoxyethyl)-3-(phenylmethyl)-1-(pyridin-3-ylmethyl)-3,5-dihydro-2H-1,4-benzodiazepine-4-sulfonamide Openeye Name: 3-benzyl-7-cyano-N-(2-methoxyethyl)-1-(3-pyridylmethyl)-3,5-dihydro-2H-1,4-benzodiazepine-4-sulfonamide CAS Name: 7-cyano-N-(2-methoxyethyl)-3-(phenylmethyl)-1-(3-pyridinylmethyl)-3,5-dihydro-2H-1,4-benzodiazepine-4-sulfonamide IUPAC Name: 3-benzyl-7-cyano-N-(2-methoxyethyl)-1-(pyridin-3-ylmethyl)-3,5-dihydro-2H-1,4-benzodiazepine-4-sulfonamide Traditional Name: 3-benzyl-7-cyano-N-(2-methoxyethyl)-1-(3-pyridylmethyl)-3,5-dihydro-2H-1,4-benzodiazepine-4-sulfonamide Formula: C26H29N5O3S MolecularWeight: 491.60516

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Descriptors Computed from Structure

Canonical SMILES:

COCCNS(=O)(=O)N1CC2=C(C=CC(=C2)C#N)N(CC1CC3=CC=CC=C3)CC4=CN=CC=C4

Isomeric SMILES

COCCNS(=O)(=O)N1CC2=C(C=CC(=C2)C#N)N(CC1CC3=CC=CC=C3)CC4=CN=CC=C4

InChI

InChI=1S/C26H29N5O3S/c1-34-13-12-29-35(32,33)31-19-24-14-22(16-27)9-10-26(24)30(18-23-8-5-11-28-17-23)20-25(31)15-21-6-3-2-4-7-21/h2-11,14,17,25,29H,12-13,15,18-20H2,1H3