2-[3-cyano-6-(3,4-dimethoxyphenyl)pyridin-2-yl]sulfanyl-N-cyclopropyl-ethanamide

Systemtic Name: 2-[3-cyano-6-(3,4-dimethoxyphenyl)pyridin-2-yl]sulfanyl-N-cyclopropyl-ethanamide Openeye Name: 2-[[3-cyano-6-(3,4-dimethoxyphenyl)-2-pyridyl]sulfanyl]-N-cyclopropyl-acetamide CAS Name: 2-[[3-cyano-6-(3,4-dimethoxyphenyl)-2-pyridinyl]thio]-N-cyclopropylacetamide IUPAC Name: 2-[3-cyano-6-(3,4-dimethoxyphenyl)pyridin-2-yl]sulfanyl-N-cyclopropylacetamide Traditional Name: 2-[[3-cyano-6-(3,4-dimethoxyphenyl)-2-pyridyl]thio]-N-cyclopropyl-acetamide Formula: C19H19N3O3S MolecularWeight: 369.43746

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC(=C(C=C2)C#N)SCC(=O)NC3CC3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC(=C(C=C2)C#N)SCC(=O)NC3CC3)OC

InChI

InChI=1S/C19H19N3O3S/c1-24-16-8-4-12(9-17(16)25-2)15-7-3-13(10-20)19(22-15)26-11-18(23)21-14-5-6-14/h3-4,7-9,14H,5-6,11H2,1-2H3,(H,21,23)