2-[4-(4-chlorophenyl)-3,5-dicyano-6-methyl-pyridin-2-yl]sulfanyl-N-cyclohexyl-ethanamide

Systemtic Name: 2-[4-(4-chlorophenyl)-3,5-dicyano-6-methyl-pyridin-2-yl]sulfanyl-N-cyclohexyl-ethanamide Openeye Name: 2-[[4-(4-chlorophenyl)-3,5-dicyano-6-methyl-2-pyridyl]sulfanyl]-N-cyclohexyl-acetamide CAS Name: 2-[[4-(4-chlorophenyl)-3,5-dicyano-6-methyl-2-pyridinyl]thio]-N-cyclohexylacetamide IUPAC Name: 2-[4-(4-chlorophenyl)-3,5-dicyano-6-methylpyridin-2-yl]sulfanyl-N-cyclohexylacetamide Traditional Name: 2-[[4-(4-chlorophenyl)-3,5-dicyano-6-methyl-2-pyridyl]thio]-N-cyclohexyl-acetamide Formula: C22H21ClN4OS MolecularWeight: 424.94634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(=C1C#N)C2=CC=C(C=C2)Cl)C#N)SCC(=O)NC3CCCCC3

Isomeric SMILES

CC1=NC(=C(C(=C1C#N)C2=CC=C(C=C2)Cl)C#N)SCC(=O)NC3CCCCC3

InChI

InChI=1S/C22H21ClN4OS/c1-14-18(11-24)21(15-7-9-16(23)10-8-15)19(12-25)22(26-14)29-13-20(28)27-17-5-3-2-4-6-17/h7-10,17H,2-6,13H2,1H3,(H,27,28)