2-[6-(4-chlorophenyl)-3-cyano-pyridin-2-yl]sulfanyl-N-(3,4-dimethylphenyl)butanamide

Systemtic Name: 2-[6-(4-chlorophenyl)-3-cyano-pyridin-2-yl]sulfanyl-N-(3,4-dimethylphenyl)butanamide Openeye Name: 2-[[6-(4-chlorophenyl)-3-cyano-2-pyridyl]sulfanyl]-N-(3,4-dimethylphenyl)butanamide CAS Name: 2-[[6-(4-chlorophenyl)-3-cyano-2-pyridinyl]thio]-N-(3,4-dimethylphenyl)butanamide IUPAC Name: 2-[6-(4-chlorophenyl)-3-cyanopyridin-2-yl]sulfanyl-N-(3,4-dimethylphenyl)butanamide Traditional Name: 2-[[6-(4-chlorophenyl)-3-cyano-2-pyridyl]thio]-N-(3,4-dimethylphenyl)butyramide Formula: C24H22ClN3OS MolecularWeight: 435.96898

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC(=C(C=C1)C)C)SC2=C(C=CC(=N2)C3=CC=C(C=C3)Cl)C#N

Isomeric SMILES

CCC(C(=O)NC1=CC(=C(C=C1)C)C)SC2=C(C=CC(=N2)C3=CC=C(C=C3)Cl)C#N

InChI

InChI=1S/C24H22ClN3OS/c1-4-22(23(29)27-20-11-5-15(2)16(3)13-20)30-24-18(14-26)8-12-21(28-24)17-6-9-19(25)10-7-17/h5-13,22H,4H2,1-3H3,(H,27,29)