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

Systemtic Name: N'-[2-(4-methylphenyl)sulfonyl-2-pyridin-3-yl-ethyl]-N-(2-thiophen-2-ylethyl)ethanediamide Openeye Name: N'-[2-(p-tolylsulfonyl)-2-(3-pyridyl)ethyl]-N-[2-(2-thienyl)ethyl]oxamide CAS Name: N'-[2-(4-methylphenyl)sulfonyl-2-(3-pyridinyl)ethyl]-N-(2-thiophen-2-ylethyl)oxamide IUPAC Name: N'-[2-(4-methylphenyl)sulfonyl-2-pyridin-3-ylethyl]-N-(2-thiophen-2-ylethyl)oxamide Traditional Name: N'-[2-(3-pyridyl)-2-tosyl-ethyl]-N-[2-(2-thienyl)ethyl]oxamide Formula: C22H23N3O4S2 MolecularWeight: 457.56572

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(CNC(=O)C(=O)NCCC2=CC=CS2)C3=CN=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C(CNC(=O)C(=O)NCCC2=CC=CS2)C3=CN=CC=C3

InChI

InChI=1S/C22H23N3O4S2/c1-16-6-8-19(9-7-16)31(28,29)20(17-4-2-11-23-14-17)15-25-22(27)21(26)24-12-10-18-5-3-13-30-18/h2-9,11,13-14,20H,10,12,15H2,1H3,(H,24,26)(H,25,27)