N-[[2-(dimethylsulfamoyl)phenyl]methyl]-2-phenylsulfanyl-pyridine-3-carboxamide

Systemtic Name: N-[[2-(dimethylsulfamoyl)phenyl]methyl]-2-phenylsulfanyl-pyridine-3-carboxamide Openeye Name: N-[[2-(dimethylsulfamoyl)phenyl]methyl]-2-phenylsulfanyl-pyridine-3-carboxamide CAS Name: N-[[2-(dimethylsulfamoyl)phenyl]methyl]-2-(phenylthio)-3-pyridinecarboxamide IUPAC Name: N-[[2-(dimethylsulfamoyl)phenyl]methyl]-2-phenylsulfanylpyridine-3-carboxamide Traditional Name: N-[2-(dimethylsulfamoyl)benzyl]-2-(phenylthio)nicotinamide Formula: C21H21N3O3S2 MolecularWeight: 427.53974

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=CC=C1CNC(=O)C2=C(N=CC=C2)SC3=CC=CC=C3

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=CC=C1CNC(=O)C2=C(N=CC=C2)SC3=CC=CC=C3

InChI

InChI=1S/C21H21N3O3S2/c1-24(2)29(26,27)19-13-7-6-9-16(19)15-23-20(25)18-12-8-14-22-21(18)28-17-10-4-3-5-11-17/h3-14H,15H2,1-2H3,(H,23,25)