N-[[4-[3-cyano-2-(cyanomethyl)propyl]phenyl]methyl]-2-nitro-N-(pyridin-2-ylmethyl)benzenesulfonamide

Systemtic Name: N-[[4-[3-cyano-2-(cyanomethyl)propyl]phenyl]methyl]-2-nitro-N-(pyridin-2-ylmethyl)benzenesulfonamide Openeye Name: N-[[4-[3-cyano-2-(cyanomethyl)propyl]phenyl]methyl]-2-nitro-N-(2-pyridylmethyl)benzenesulfonamide CAS Name: N-[[4-[3-cyano-2-(cyanomethyl)propyl]phenyl]methyl]-2-nitro-N-(2-pyridinylmethyl)benzenesulfonamide IUPAC Name: N-[[4-[3-cyano-2-(cyanomethyl)propyl]phenyl]methyl]-2-nitro-N-(pyridin-2-ylmethyl)benzenesulfonamide Traditional Name: N-[4-[3-cyano-2-(cyanomethyl)propyl]benzyl]-2-nitro-N-(2-pyridylmethyl)benzenesulfonamide Formula: C25H23N5O4S MolecularWeight: 489.54622

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)[N+](=O)[O-])S(=O)(=O)N(CC2=CC=C(C=C2)CC(CC#N)CC#N)CC3=CC=CC=N3

Isomeric SMILES

C1=CC=C(C(=C1)[N+](=O)[O-])S(=O)(=O)N(CC2=CC=C(C=C2)CC(CC#N)CC#N)CC3=CC=CC=N3

InChI

InChI=1S/C25H23N5O4S/c26-14-12-21(13-15-27)17-20-8-10-22(11-9-20)18-29(19-23-5-3-4-16-28-23)35(33,34)25-7-2-1-6-24(25)30(31)32/h1-11,16,21H,12-13,17-19H2