2-(3-cyano-4,6-dimethyl-pyridin-2-yl)sulfanyl-N-(3-morpholin-4-ylsulfonylphenyl)ethanamide

Systemtic Name: 2-(3-cyano-4,6-dimethyl-pyridin-2-yl)sulfanyl-N-(3-morpholin-4-ylsulfonylphenyl)ethanamide Openeye Name: 2-[(3-cyano-4,6-dimethyl-2-pyridyl)sulfanyl]-N-(3-morpholinosulfonylphenyl)acetamide CAS Name: 2-[(3-cyano-4,6-dimethyl-2-pyridinyl)thio]-N-[3-(4-morpholinylsulfonyl)phenyl]acetamide IUPAC Name: 2-(3-cyano-4,6-dimethylpyridin-2-yl)sulfanyl-N-(3-morpholin-4-ylsulfonylphenyl)acetamide Traditional Name: 2-[(3-cyano-4,6-dimethyl-2-pyridyl)thio]-N-(3-morpholinosulfonylphenyl)acetamide Formula: C20H22N4O4S2 MolecularWeight: 446.54308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C1C#N)SCC(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCOCC3)C

Isomeric SMILES

CC1=CC(=NC(=C1C#N)SCC(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCOCC3)C

InChI

InChI=1S/C20H22N4O4S2/c1-14-10-15(2)22-20(18(14)12-21)29-13-19(25)23-16-4-3-5-17(11-16)30(26,27)24-6-8-28-9-7-24/h3-5,10-11H,6-9,13H2,1-2H3,(H,23,25)