3-cyano-6-cyclopropyl-2-methylsulfanyl-N-[[3-(methylsulfonylamino)phenyl]methyl]pyridine-4-carboxamide

Systemtic Name: 3-cyano-6-cyclopropyl-2-methylsulfanyl-N-[[3-(methylsulfonylamino)phenyl]methyl]pyridine-4-carboxamide Openeye Name: 3-cyano-6-cyclopropyl-N-[[3-(methanesulfonamido)phenyl]methyl]-2-methylsulfanyl-pyridine-4-carboxamide CAS Name: 3-cyano-6-cyclopropyl-N-[[3-(methanesulfonamido)phenyl]methyl]-2-(methylthio)-4-pyridinecarboxamide IUPAC Name: 3-cyano-6-cyclopropyl-N-[[3-(methanesulfonamido)phenyl]methyl]-2-methylsulfanylpyridine-4-carboxamide Traditional Name: 3-cyano-6-cyclopropyl-N-[3-(methanesulfonamido)benzyl]-2-(methylthio)isonicotinamide Formula: C19H20N4O3S2 MolecularWeight: 416.5171

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C(=CC(=N1)C2CC2)C(=O)NCC3=CC(=CC=C3)NS(=O)(=O)C)C#N

Isomeric SMILES

CSC1=C(C(=CC(=N1)C2CC2)C(=O)NCC3=CC(=CC=C3)NS(=O)(=O)C)C#N

InChI

InChI=1S/C19H20N4O3S2/c1-27-19-16(10-20)15(9-17(22-19)13-6-7-13)18(24)21-11-12-4-3-5-14(8-12)23-28(2,25)26/h3-5,8-9,13,23H,6-7,11H2,1-2H3,(H,21,24)