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

Systemtic Name: 2-[(3-cyano-6-methyl-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]-N-(3-methylpyridin-2-yl)butanamide Openeye Name: 2-[(3-cyano-6-methyl-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]-N-(3-methyl-2-pyridyl)butanamide CAS Name: 2-[(3-cyano-6-methyl-5,6,7,8-tetrahydroquinolin-2-yl)thio]-N-(3-methyl-2-pyridinyl)butanamide IUPAC Name: 2-[(3-cyano-6-methyl-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]-N-(3-methylpyridin-2-yl)butanamide Traditional Name: 2-[(3-cyano-6-methyl-5,6,7,8-tetrahydroquinolin-2-yl)thio]-N-(3-methyl-2-pyridyl)butyramide Formula: C21H24N4OS MolecularWeight: 380.50646

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=C(C=CC=N1)C)SC2=NC3=C(CC(CC3)C)C=C2C#N

Isomeric SMILES

CCC(C(=O)NC1=C(C=CC=N1)C)SC2=NC3=C(CC(CC3)C)C=C2C#N

InChI

InChI=1S/C21H24N4OS/c1-4-18(20(26)25-19-14(3)6-5-9-23-19)27-21-16(12-22)11-15-10-13(2)7-8-17(15)24-21/h5-6,9,11,13,18H,4,7-8,10H2,1-3H3,(H,23,25,26)