2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)-N-[3-(dimethylsulfamoyl)phenyl]ethanamide

Systemtic Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)-N-[3-(dimethylsulfamoyl)phenyl]ethanamide Openeye Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)-N-[3-(dimethylsulfamoyl)phenyl]acetamide CAS Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylthio)-N-[3-(dimethylsulfamoyl)phenyl]acetamide IUPAC Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)-N-[3-(dimethylsulfamoyl)phenyl]acetamide Traditional Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylthio)-N-[3-(dimethylsulfamoyl)phenyl]acetamide Formula: C19H22N2O5S2 MolecularWeight: 422.51838

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=CC(=C1)NC(=O)CSC2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=CC(=C1)NC(=O)CSC2=CC3=C(C=C2)OCCCO3

InChI

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