N'-[2-(4-methylphenyl)sulfonyl-2-pyridin-3-yl-ethyl]-N-(pyridin-2-ylmethyl)ethanediamide

Systemtic Name: N'-[2-(4-methylphenyl)sulfonyl-2-pyridin-3-yl-ethyl]-N-(pyridin-2-ylmethyl)ethanediamide Openeye Name: N'-[2-(p-tolylsulfonyl)-2-(3-pyridyl)ethyl]-N-(2-pyridylmethyl)oxamide CAS Name: N'-[2-(4-methylphenyl)sulfonyl-2-(3-pyridinyl)ethyl]-N-(2-pyridinylmethyl)oxamide IUPAC Name: N'-[2-(4-methylphenyl)sulfonyl-2-pyridin-3-ylethyl]-N-(pyridin-2-ylmethyl)oxamide Traditional Name: N-(2-pyridylmethyl)-N'-[2-(3-pyridyl)-2-tosyl-ethyl]oxamide Formula: C22H22N4O4S MolecularWeight: 438.49948

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(CNC(=O)C(=O)NCC2=CC=CC=N2)C3=CN=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C(CNC(=O)C(=O)NCC2=CC=CC=N2)C3=CN=CC=C3

InChI

InChI=1S/C22H22N4O4S/c1-16-7-9-19(10-8-16)31(29,30)20(17-5-4-11-23-13-17)15-26-22(28)21(27)25-14-18-6-2-3-12-24-18/h2-13,20H,14-15H2,1H3,(H,25,27)(H,26,28)