7-cyano-N-(2-methoxyethyl)-N-methyl-3-(phenylmethyl)-1,2,3,5-tetrahydro-1,4-benzodiazepine-4-sulfonamide

Systemtic Name: 7-cyano-N-(2-methoxyethyl)-N-methyl-3-(phenylmethyl)-1,2,3,5-tetrahydro-1,4-benzodiazepine-4-sulfonamide Openeye Name: 3-benzyl-7-cyano-N-(2-methoxyethyl)-N-methyl-1,2,3,5-tetrahydro-1,4-benzodiazepine-4-sulfonamide CAS Name: 7-cyano-N-(2-methoxyethyl)-N-methyl-3-(phenylmethyl)-1,2,3,5-tetrahydro-1,4-benzodiazepine-4-sulfonamide IUPAC Name: 3-benzyl-7-cyano-N-(2-methoxyethyl)-N-methyl-1,2,3,5-tetrahydro-1,4-benzodiazepine-4-sulfonamide Traditional Name: 3-benzyl-7-cyano-N-(2-methoxyethyl)-N-methyl-1,2,3,5-tetrahydro-1,4-benzodiazepine-4-sulfonamide Formula: C21H26N4O3S MolecularWeight: 414.52114

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCOC)S(=O)(=O)N1CC2=C(C=CC(=C2)C#N)NCC1CC3=CC=CC=C3

Isomeric SMILES

CN(CCOC)S(=O)(=O)N1CC2=C(C=CC(=C2)C#N)NCC1CC3=CC=CC=C3

InChI

InChI=1S/C21H26N4O3S/c1-24(10-11-28-2)29(26,27)25-16-19-12-18(14-22)8-9-21(19)23-15-20(25)13-17-6-4-3-5-7-17/h3-9,12,20,23H,10-11,13,15-16H2,1-2H3