N-(4-cyano-2-phenyl-pyrazol-3-yl)-2-(4-methylquinolin-2-yl)sulfanyl-propanamide

Systemtic Name: N-(4-cyano-2-phenyl-pyrazol-3-yl)-2-(4-methylquinolin-2-yl)sulfanyl-propanamide Openeye Name: N-(4-cyano-2-phenyl-pyrazol-3-yl)-2-[(4-methyl-2-quinolyl)sulfanyl]propanamide CAS Name: N-(4-cyano-2-phenyl-3-pyrazolyl)-2-[(4-methyl-2-quinolinyl)thio]propanamide IUPAC Name: N-(4-cyano-2-phenylpyrazol-3-yl)-2-(4-methylquinolin-2-yl)sulfanylpropanamide Traditional Name: N-(4-cyano-2-phenyl-pyrazol-3-yl)-2-[(4-methyl-2-quinolyl)thio]propionamide Formula: C23H19N5OS MolecularWeight: 413.49486

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=CC=CC=C12)SC(C)C(=O)NC3=C(C=NN3C4=CC=CC=C4)C#N

Isomeric SMILES

CC1=CC(=NC2=CC=CC=C12)SC(C)C(=O)NC3=C(C=NN3C4=CC=CC=C4)C#N

InChI

InChI=1S/C23H19N5OS/c1-15-12-21(26-20-11-7-6-10-19(15)20)30-16(2)23(29)27-22-17(13-24)14-25-28(22)18-8-4-3-5-9-18/h3-12,14,16H,1-2H3,(H,27,29)