N-[2,2-bis(fluoranyl)-1,3-benzodioxol-5-yl]-2-(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[2,2-bis(fluoranyl)-1,3-benzodioxol-5-yl]-2-(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanyl-ethanamide Openeye Name: N-(2,2-difluoro-1,3-benzodioxol-5-yl)-2-[[5-(1-piperidylsulfonyl)-2-pyridyl]sulfanyl]acetamide CAS Name: N-(2,2-difluoro-1,3-benzodioxol-5-yl)-2-[[5-(1-piperidinylsulfonyl)-2-pyridinyl]thio]acetamide IUPAC Name: N-(2,2-difluoro-1,3-benzodioxol-5-yl)-2-(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanylacetamide Traditional Name: N-(2,2-difluoro-1,3-benzodioxol-5-yl)-2-[(5-piperidinosulfonyl-2-pyridyl)thio]acetamide Formula: C19H19F2N3O5S2 MolecularWeight: 471.498066

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CN=C(C=C2)SCC(=O)NC3=CC4=C(C=C3)OC(O4)(F)F

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CN=C(C=C2)SCC(=O)NC3=CC4=C(C=C3)OC(O4)(F)F

InChI

InChI=1S/C19H19F2N3O5S2/c20-19(21)28-15-6-4-13(10-16(15)29-19)23-17(25)12-30-18-7-5-14(11-22-18)31(26,27)24-8-2-1-3-9-24/h4-7,10-11H,1-3,8-9,12H2,(H,23,25)