N-(2-cyanoethyl)-2-[5-(diethylsulfamoyl)pyridin-2-yl]sulfanyl-N-phenyl-propanamide

Systemtic Name: N-(2-cyanoethyl)-2-[5-(diethylsulfamoyl)pyridin-2-yl]sulfanyl-N-phenyl-propanamide Openeye Name: N-(2-cyanoethyl)-2-[[5-(diethylsulfamoyl)-2-pyridyl]sulfanyl]-N-phenyl-propanamide CAS Name: N-(2-cyanoethyl)-2-[[5-(diethylsulfamoyl)-2-pyridinyl]thio]-N-phenylpropanamide IUPAC Name: N-(2-cyanoethyl)-2-[5-(diethylsulfamoyl)pyridin-2-yl]sulfanyl-N-phenylpropanamide Traditional Name: N-(2-cyanoethyl)-2-[[5-(diethylsulfamoyl)-2-pyridyl]thio]-N-phenyl-propionamide Formula: C21H26N4O3S2 MolecularWeight: 446.58614

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26N4O3S2/c1-4-24(5-2)30(27,28)19-12-13-20(23-16-19)29-17(3)21(26)25(15-9-14-22)18-10-7-6-8-11-18/h6-8,10-13,16-17H,4-5,9,15H2,1-3H3