N-(1,3-benzodioxol-5-yl)-2-[3-cyano-6-(4-methoxyphenyl)-4-thiophen-2-yl-pyridin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-2-[3-cyano-6-(4-methoxyphenyl)-4-thiophen-2-yl-pyridin-2-yl]sulfanyl-ethanamide Openeye Name: N-(1,3-benzodioxol-5-yl)-2-[[3-cyano-6-(4-methoxyphenyl)-4-(2-thienyl)-2-pyridyl]sulfanyl]acetamide CAS Name: N-(1,3-benzodioxol-5-yl)-2-[[3-cyano-6-(4-methoxyphenyl)-4-thiophen-2-yl-2-pyridinyl]thio]acetamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-2-[3-cyano-6-(4-methoxyphenyl)-4-thiophen-2-ylpyridin-2-yl]sulfanylacetamide Traditional Name: N-(1,3-benzodioxol-5-yl)-2-[[3-cyano-6-(4-methoxyphenyl)-4-(2-thienyl)-2-pyridyl]thio]acetamide Formula: C26H19N3O4S2 MolecularWeight: 501.57676

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC(=C(C(=C2)C3=CC=CS3)C#N)SCC(=O)NC4=CC5=C(C=C4)OCO5

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC(=C(C(=C2)C3=CC=CS3)C#N)SCC(=O)NC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C26H19N3O4S2/c1-31-18-7-4-16(5-8-18)21-12-19(24-3-2-10-34-24)20(13-27)26(29-21)35-14-25(30)28-17-6-9-22-23(11-17)33-15-32-22/h2-12H,14-15H2,1H3,(H,28,30)