N-[(4-cyanophenyl)methyl]-4-nitro-N-(pyridin-2-ylmethyl)benzenesulfonamide

Systemtic Name: N-[(4-cyanophenyl)methyl]-4-nitro-N-(pyridin-2-ylmethyl)benzenesulfonamide Openeye Name: N-[(4-cyanophenyl)methyl]-4-nitro-N-(2-pyridylmethyl)benzenesulfonamide CAS Name: N-[(4-cyanophenyl)methyl]-4-nitro-N-(2-pyridinylmethyl)benzenesulfonamide IUPAC Name: N-[(4-cyanophenyl)methyl]-4-nitro-N-(pyridin-2-ylmethyl)benzenesulfonamide Traditional Name: N-(4-cyanobenzyl)-4-nitro-N-(2-pyridylmethyl)benzenesulfonamide Formula: C20H16N4O4S MolecularWeight: 408.43044

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)CN(CC2=CC=C(C=C2)C#N)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=NC(=C1)CN(CC2=CC=C(C=C2)C#N)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H16N4O4S/c21-13-16-4-6-17(7-5-16)14-23(15-18-3-1-2-12-22-18)29(27,28)20-10-8-19(9-11-20)24(25)26/h1-12H,14-15H2