N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-[5-(dimethylsulfamoyl)pyridin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-[5-(dimethylsulfamoyl)pyridin-2-yl]sulfanyl-ethanamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-[[5-(dimethylsulfamoyl)-2-pyridyl]sulfanyl]acetamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-[[5-(dimethylsulfamoyl)-2-pyridinyl]thio]acetamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-[5-(dimethylsulfamoyl)pyridin-2-yl]sulfanylacetamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-[[5-(dimethylsulfamoyl)-2-pyridyl]thio]acetamide Formula: C18H21N3O5S2 MolecularWeight: 423.50644

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CN=C(C=C1)SCC(=O)NCC2COC3=CC=CC=C3O2

Isomeric SMILES

CN(C)S(=O)(=O)C1=CN=C(C=C1)SCC(=O)NCC2COC3=CC=CC=C3O2

InChI

InChI=1S/C18H21N3O5S2/c1-21(2)28(23,24)14-7-8-18(20-10-14)27-12-17(22)19-9-13-11-25-15-5-3-4-6-16(15)26-13/h3-8,10,13H,9,11-12H2,1-2H3,(H,19,22)