2-[3-cyano-4-(methoxymethyl)-6-methyl-pyridin-2-yl]sulfanyl-N-(4-morpholin-4-ylphenyl)ethanamide

Systemtic Name: 2-[3-cyano-4-(methoxymethyl)-6-methyl-pyridin-2-yl]sulfanyl-N-(4-morpholin-4-ylphenyl)ethanamide Openeye Name: 2-[[3-cyano-4-(methoxymethyl)-6-methyl-2-pyridyl]sulfanyl]-N-(4-morpholinophenyl)acetamide CAS Name: 2-[[3-cyano-4-(methoxymethyl)-6-methyl-2-pyridinyl]thio]-N-[4-(4-morpholinyl)phenyl]acetamide IUPAC Name: 2-[3-cyano-4-(methoxymethyl)-6-methylpyridin-2-yl]sulfanyl-N-(4-morpholin-4-ylphenyl)acetamide Traditional Name: 2-[[3-cyano-4-(methoxymethyl)-6-methyl-2-pyridyl]thio]-N-(4-morpholinophenyl)acetamide Formula: C21H24N4O3S MolecularWeight: 412.50526

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(=C1)COC)C#N)SCC(=O)NC2=CC=C(C=C2)N3CCOCC3

Isomeric SMILES

CC1=NC(=C(C(=C1)COC)C#N)SCC(=O)NC2=CC=C(C=C2)N3CCOCC3

InChI

InChI=1S/C21H24N4O3S/c1-15-11-16(13-27-2)19(12-22)21(23-15)29-14-20(26)24-17-3-5-18(6-4-17)25-7-9-28-10-8-25/h3-6,11H,7-10,13-14H2,1-2H3,(H,24,26)