2-(3-cyano-4,6-dimethyl-pyridin-2-yl)sulfanyl-N-[4-(pyridin-2-ylsulfamoyl)phenyl]ethanamide

Systemtic Name: 2-(3-cyano-4,6-dimethyl-pyridin-2-yl)sulfanyl-N-[4-(pyridin-2-ylsulfamoyl)phenyl]ethanamide Openeye Name: 2-[(3-cyano-4,6-dimethyl-2-pyridyl)sulfanyl]-N-[4-(2-pyridylsulfamoyl)phenyl]acetamide CAS Name: 2-[(3-cyano-4,6-dimethyl-2-pyridinyl)thio]-N-[4-(2-pyridinylsulfamoyl)phenyl]acetamide IUPAC Name: 2-(3-cyano-4,6-dimethylpyridin-2-yl)sulfanyl-N-[4-(pyridin-2-ylsulfamoyl)phenyl]acetamide Traditional Name: 2-[(3-cyano-4,6-dimethyl-2-pyridyl)thio]-N-[4-(2-pyridylsulfamoyl)phenyl]acetamide Formula: C21H19N5O3S2 MolecularWeight: 453.53726

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C1C#N)SCC(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=CC=CC=N3)C

Isomeric SMILES

CC1=CC(=NC(=C1C#N)SCC(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=CC=CC=N3)C

InChI

InChI=1S/C21H19N5O3S2/c1-14-11-15(2)24-21(18(14)12-22)30-13-20(27)25-16-6-8-17(9-7-16)31(28,29)26-19-5-3-4-10-23-19/h3-11H,13H2,1-2H3,(H,23,26)(H,25,27)