N-(1,3-benzodioxol-5-yl)-3-[[3-(dimethylsulfamoyl)phenyl]methylsulfanyl]propanamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-3-[[3-(dimethylsulfamoyl)phenyl]methylsulfanyl]propanamide Openeye Name: N-(1,3-benzodioxol-5-yl)-3-[[3-(dimethylsulfamoyl)phenyl]methylsulfanyl]propanamide CAS Name: N-(1,3-benzodioxol-5-yl)-3-[[3-(dimethylsulfamoyl)phenyl]methylthio]propanamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-3-[[3-(dimethylsulfamoyl)phenyl]methylsulfanyl]propanamide Traditional Name: N-(1,3-benzodioxol-5-yl)-3-[[3-(dimethylsulfamoyl)benzyl]thio]propionamide Formula: C19H22N2O5S2 MolecularWeight: 422.51838

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=CC(=C1)CSCCC(=O)NC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=CC(=C1)CSCCC(=O)NC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C19H22N2O5S2/c1-21(2)28(23,24)16-5-3-4-14(10-16)12-27-9-8-19(22)20-15-6-7-17-18(11-15)26-13-25-17/h3-7,10-11H,8-9,12-13H2,1-2H3,(H,20,22)