2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]-N-[[2-(methylsulfamoylmethyl)phenyl]methyl]pyridine-3-carboxamide

Systemtic Name: 2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]-N-[[2-(methylsulfamoylmethyl)phenyl]methyl]pyridine-3-carboxamide Openeye Name: 2-[(5-methylisoxazol-3-yl)methylsulfanyl]-N-[[2-(methylsulfamoylmethyl)phenyl]methyl]pyridine-3-carboxamide CAS Name: 2-[(5-methyl-3-isoxazolyl)methylthio]-N-[[2-(methylsulfamoylmethyl)phenyl]methyl]-3-pyridinecarboxamide IUPAC Name: 2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]-N-[[2-(methylsulfamoylmethyl)phenyl]methyl]pyridine-3-carboxamide Traditional Name: 2-[(5-methylisoxazol-3-yl)methylthio]-N-[2-(methylsulfamoylmethyl)benzyl]nicotinamide Formula: C20H22N4O4S2 MolecularWeight: 446.54308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)CSC2=C(C=CC=N2)C(=O)NCC3=CC=CC=C3CS(=O)(=O)NC

Isomeric SMILES

CC1=CC(=NO1)CSC2=C(C=CC=N2)C(=O)NCC3=CC=CC=C3CS(=O)(=O)NC

InChI

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