3-cyano-6-cyclopropyl-2-methylsulfanyl-N-quinolin-3-yl-pyridine-4-carboxamide

Systemtic Name: 3-cyano-6-cyclopropyl-2-methylsulfanyl-N-quinolin-3-yl-pyridine-4-carboxamide Openeye Name: 3-cyano-6-cyclopropyl-2-methylsulfanyl-N-(3-quinolyl)pyridine-4-carboxamide CAS Name: 3-cyano-6-cyclopropyl-2-(methylthio)-N-(3-quinolinyl)-4-pyridinecarboxamide IUPAC Name: 3-cyano-6-cyclopropyl-2-methylsulfanyl-N-quinolin-3-ylpyridine-4-carboxamide Traditional Name: 3-cyano-6-cyclopropyl-2-(methylthio)-N-(3-quinolyl)isonicotinamide Formula: C20H16N4OS MolecularWeight: 360.43224

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C(=CC(=N1)C2CC2)C(=O)NC3=CC4=CC=CC=C4N=C3)C#N

Isomeric SMILES

CSC1=C(C(=CC(=N1)C2CC2)C(=O)NC3=CC4=CC=CC=C4N=C3)C#N

InChI

InChI=1S/C20H16N4OS/c1-26-20-16(10-21)15(9-18(24-20)12-6-7-12)19(25)23-14-8-13-4-2-3-5-17(13)22-11-14/h2-5,8-9,11-12H,6-7H2,1H3,(H,23,25)