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

Systemtic Name: N-(4-bromanyl-3-methyl-phenyl)-2-[3-cyano-4-(methoxymethyl)-6-methyl-pyridin-2-yl]sulfanyl-ethanamide Openeye Name: N-(4-bromo-3-methyl-phenyl)-2-[[3-cyano-4-(methoxymethyl)-6-methyl-2-pyridyl]sulfanyl]acetamide CAS Name: N-(4-bromo-3-methylphenyl)-2-[[3-cyano-4-(methoxymethyl)-6-methyl-2-pyridinyl]thio]acetamide IUPAC Name: N-(4-bromo-3-methylphenyl)-2-[3-cyano-4-(methoxymethyl)-6-methylpyridin-2-yl]sulfanylacetamide Traditional Name: N-(4-bromo-3-methyl-phenyl)-2-[[3-cyano-4-(methoxymethyl)-6-methyl-2-pyridyl]thio]acetamide Formula: C18H18BrN3O2S MolecularWeight: 420.32342

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)CSC2=C(C(=CC(=N2)C)COC)C#N)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)CSC2=C(C(=CC(=N2)C)COC)C#N)Br

InChI

InChI=1S/C18H18BrN3O2S/c1-11-6-14(4-5-16(11)19)22-17(23)10-25-18-15(8-20)13(9-24-3)7-12(2)21-18/h4-7H,9-10H2,1-3H3,(H,22,23)