2-[(3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]-N-(3-methylpyridin-2-yl)propanamide

Systemtic Name: 2-[(3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]-N-(3-methylpyridin-2-yl)propanamide Openeye Name: 2-[(3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]-N-(3-methyl-2-pyridyl)propanamide CAS Name: 2-[(3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)thio]-N-(3-methyl-2-pyridinyl)propanamide IUPAC Name: 2-[(3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]-N-(3-methylpyridin-2-yl)propanamide Traditional Name: 2-[(3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)thio]-N-(3-methyl-2-pyridyl)propionamide Formula: C19H20N4OS MolecularWeight: 352.4533

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CC=C1)NC(=O)C(C)SC2=NC3=C(CCCC3)C=C2C#N

Isomeric SMILES

CC1=C(N=CC=C1)NC(=O)C(C)SC2=NC3=C(CCCC3)C=C2C#N

InChI

InChI=1S/C19H20N4OS/c1-12-6-5-9-21-17(12)23-18(24)13(2)25-19-15(11-20)10-14-7-3-4-8-16(14)22-19/h5-6,9-10,13H,3-4,7-8H2,1-2H3,(H,21,23,24)