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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C=C(C(=N2)SCCC(=O)NC3=CN=CC=C3)C#N

Isomeric SMILES

CC1CCC2=C(C1)C=C(C(=N2)SCCC(=O)NC3=CN=CC=C3)C#N

InChI

InChI=1S/C19H20N4OS/c1-13-4-5-17-14(9-13)10-15(11-20)19(23-17)25-8-6-18(24)22-16-3-2-7-21-12-16/h2-3,7,10,12-13H,4-6,8-9H2,1H3,(H,22,24)