N-(2-cyanoethyl)-2-[5-(dimethylsulfamoyl)pyridin-2-yl]sulfanyl-N-phenyl-ethanamide

Systemtic Name: N-(2-cyanoethyl)-2-[5-(dimethylsulfamoyl)pyridin-2-yl]sulfanyl-N-phenyl-ethanamide Openeye Name: N-(2-cyanoethyl)-2-[[5-(dimethylsulfamoyl)-2-pyridyl]sulfanyl]-N-phenyl-acetamide CAS Name: N-(2-cyanoethyl)-2-[[5-(dimethylsulfamoyl)-2-pyridinyl]thio]-N-phenylacetamide IUPAC Name: N-(2-cyanoethyl)-2-[5-(dimethylsulfamoyl)pyridin-2-yl]sulfanyl-N-phenylacetamide Traditional Name: N-(2-cyanoethyl)-2-[[5-(dimethylsulfamoyl)-2-pyridyl]thio]-N-phenyl-acetamide Formula: C18H20N4O3S2 MolecularWeight: 404.5064

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CN=C(C=C1)SCC(=O)N(CCC#N)C2=CC=CC=C2

Isomeric SMILES

CN(C)S(=O)(=O)C1=CN=C(C=C1)SCC(=O)N(CCC#N)C2=CC=CC=C2

InChI

InChI=1S/C18H20N4O3S2/c1-21(2)27(24,25)16-9-10-17(20-13-16)26-14-18(23)22(12-6-11-19)15-7-4-3-5-8-15/h3-5,7-10,13H,6,12,14H2,1-2H3