2-(3-cyano-5-ethanoyl-6-methyl-pyridin-2-yl)sulfanyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]ethanamide

Systemtic Name: 2-(3-cyano-5-ethanoyl-6-methyl-pyridin-2-yl)sulfanyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]ethanamide Openeye Name: 2-[(5-acetyl-3-cyano-6-methyl-2-pyridyl)sulfanyl]-N-[(1-morpholinocyclohexyl)methyl]acetamide CAS Name: 2-[(5-acetyl-3-cyano-6-methyl-2-pyridinyl)thio]-N-[[1-(4-morpholinyl)cyclohexyl]methyl]acetamide IUPAC Name: 2-(5-acetyl-3-cyano-6-methylpyridin-2-yl)sulfanyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]acetamide Traditional Name: 2-[(5-acetyl-3-cyano-6-methyl-2-pyridyl)thio]-N-[(1-morpholinocyclohexyl)methyl]acetamide Formula: C22H30N4O3S MolecularWeight: 430.5636

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=N1)SCC(=O)NCC2(CCCCC2)N3CCOCC3)C#N)C(=O)C

Isomeric SMILES

CC1=C(C=C(C(=N1)SCC(=O)NCC2(CCCCC2)N3CCOCC3)C#N)C(=O)C

InChI

InChI=1S/C22H30N4O3S/c1-16-19(17(2)27)12-18(13-23)21(25-16)30-14-20(28)24-15-22(6-4-3-5-7-22)26-8-10-29-11-9-26/h12H,3-11,14-15H2,1-2H3,(H,24,28)