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

Systemtic Name: N-(3-chloranyl-4-morpholin-4-yl-phenyl)-2-[3-cyano-4-(methoxymethyl)-6-methyl-pyridin-2-yl]sulfanyl-ethanamide Openeye Name: N-(3-chloro-4-morpholino-phenyl)-2-[[3-cyano-4-(methoxymethyl)-6-methyl-2-pyridyl]sulfanyl]acetamide CAS Name: N-[3-chloro-4-(4-morpholinyl)phenyl]-2-[[3-cyano-4-(methoxymethyl)-6-methyl-2-pyridinyl]thio]acetamide IUPAC Name: N-(3-chloro-4-morpholin-4-ylphenyl)-2-[3-cyano-4-(methoxymethyl)-6-methylpyridin-2-yl]sulfanylacetamide Traditional Name: N-(3-chloro-4-morpholino-phenyl)-2-[[3-cyano-4-(methoxymethyl)-6-methyl-2-pyridyl]thio]acetamide Formula: C21H23ClN4O3S MolecularWeight: 446.95032

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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)Cl

Isomeric SMILES

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

InChI

InChI=1S/C21H23ClN4O3S/c1-14-9-15(12-28-2)17(11-23)21(24-14)30-13-20(27)25-16-3-4-19(18(22)10-16)26-5-7-29-8-6-26/h3-4,9-10H,5-8,12-13H2,1-2H3,(H,25,27)