5-cyano-2-methyl-6-(oxan-2-ylmethylsulfanyl)-N-phenyl-pyridine-3-carboxamide

Systemtic Name: 5-cyano-2-methyl-6-(oxan-2-ylmethylsulfanyl)-N-phenyl-pyridine-3-carboxamide Openeye Name: 5-cyano-2-methyl-N-phenyl-6-(tetrahydropyran-2-ylmethylsulfanyl)pyridine-3-carboxamide CAS Name: 5-cyano-2-methyl-6-(2-oxanylmethylthio)-N-phenyl-3-pyridinecarboxamide IUPAC Name: 5-cyano-2-methyl-6-(oxan-2-ylmethylsulfanyl)-N-phenylpyridine-3-carboxamide Traditional Name: 5-cyano-2-methyl-N-phenyl-6-(tetrahydropyran-2-ylmethylthio)nicotinamide Formula: C20H21N3O2S MolecularWeight: 367.46464

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=N1)SCC2CCCCO2)C#N)C(=O)NC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=C(C(=N1)SCC2CCCCO2)C#N)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C20H21N3O2S/c1-14-18(19(24)23-16-7-3-2-4-8-16)11-15(12-21)20(22-14)26-13-17-9-5-6-10-25-17/h2-4,7-8,11,17H,5-6,9-10,13H2,1H3,(H,23,24)