N'-[2-(phenylsulfonyl)-2-pyridin-3-yl-ethyl]-N-(pyridin-3-ylmethyl)ethanediamide

Systemtic Name: N'-[2-(phenylsulfonyl)-2-pyridin-3-yl-ethyl]-N-(pyridin-3-ylmethyl)ethanediamide Openeye Name: N'-[2-(benzenesulfonyl)-2-(3-pyridyl)ethyl]-N-(3-pyridylmethyl)oxamide CAS Name: N'-[2-(benzenesulfonyl)-2-(3-pyridinyl)ethyl]-N-(3-pyridinylmethyl)oxamide IUPAC Name: N'-[2-(benzenesulfonyl)-2-pyridin-3-ylethyl]-N-(pyridin-3-ylmethyl)oxamide Traditional Name: N'-[2-besyl-2-(3-pyridyl)ethyl]-N-(3-pyridylmethyl)oxamide Formula: C21H20N4O4S MolecularWeight: 424.4729

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)C(CNC(=O)C(=O)NCC2=CN=CC=C2)C3=CN=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)C(CNC(=O)C(=O)NCC2=CN=CC=C2)C3=CN=CC=C3

InChI

InChI=1S/C21H20N4O4S/c26-20(24-13-16-6-4-10-22-12-16)21(27)25-15-19(17-7-5-11-23-14-17)30(28,29)18-8-2-1-3-9-18/h1-12,14,19H,13,15H2,(H,24,26)(H,25,27)