2-(3-cyano-6-methyl-4-pyridin-3-yl-pyridin-2-yl)sulfanyl-N-(2,4-dimethylphenyl)ethanamide

Systemtic Name: 2-(3-cyano-6-methyl-4-pyridin-3-yl-pyridin-2-yl)sulfanyl-N-(2,4-dimethylphenyl)ethanamide Openeye Name: 2-[[3-cyano-6-methyl-4-(3-pyridyl)-2-pyridyl]sulfanyl]-N-(2,4-dimethylphenyl)acetamide CAS Name: 2-[[3-cyano-6-methyl-4-(3-pyridinyl)-2-pyridinyl]thio]-N-(2,4-dimethylphenyl)acetamide IUPAC Name: 2-(3-cyano-6-methyl-4-pyridin-3-ylpyridin-2-yl)sulfanyl-N-(2,4-dimethylphenyl)acetamide Traditional Name: 2-[[3-cyano-6-methyl-4-(3-pyridyl)-2-pyridyl]thio]-N-(2,4-dimethylphenyl)acetamide Formula: C22H20N4OS MolecularWeight: 388.4854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)CSC2=C(C(=CC(=N2)C)C3=CN=CC=C3)C#N)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)CSC2=C(C(=CC(=N2)C)C3=CN=CC=C3)C#N)C

InChI

InChI=1S/C22H20N4OS/c1-14-6-7-20(15(2)9-14)26-21(27)13-28-22-19(11-23)18(10-16(3)25-22)17-5-4-8-24-12-17/h4-10,12H,13H2,1-3H3,(H,26,27)