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

Systemtic Name: 2-[3-cyano-6-(2,4-dimethylphenyl)pyridin-2-yl]sulfanyl-N-phenethyl-ethanamide Openeye Name: 2-[[3-cyano-6-(2,4-dimethylphenyl)-2-pyridyl]sulfanyl]-N-phenethyl-acetamide CAS Name: 2-[[3-cyano-6-(2,4-dimethylphenyl)-2-pyridinyl]thio]-N-phenethylacetamide IUPAC Name: 2-[3-cyano-6-(2,4-dimethylphenyl)pyridin-2-yl]sulfanyl-N-phenethylacetamide Traditional Name: 2-[[3-cyano-6-(2,4-dimethylphenyl)-2-pyridyl]thio]-N-phenethyl-acetamide Formula: C24H23N3OS MolecularWeight: 401.52392

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=NC(=C(C=C2)C#N)SCC(=O)NCCC3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=C(C=C1)C2=NC(=C(C=C2)C#N)SCC(=O)NCCC3=CC=CC=C3)C

InChI

InChI=1S/C24H23N3OS/c1-17-8-10-21(18(2)14-17)22-11-9-20(15-25)24(27-22)29-16-23(28)26-13-12-19-6-4-3-5-7-19/h3-11,14H,12-13,16H2,1-2H3,(H,26,28)