N-(2-acetamidoethyl)-3-(1,3-benzodioxol-5-ylmethylamino)-5-(dimethylsulfamoyl)benzamide

Systemtic Name: N-(2-acetamidoethyl)-3-(1,3-benzodioxol-5-ylmethylamino)-5-(dimethylsulfamoyl)benzamide Openeye Name: N-(2-acetamidoethyl)-3-(1,3-benzodioxol-5-ylmethylamino)-5-(dimethylsulfamoyl)benzamide CAS Name: N-(2-acetamidoethyl)-3-(1,3-benzodioxol-5-ylmethylamino)-5-(dimethylsulfamoyl)benzamide IUPAC Name: N-(2-acetamidoethyl)-3-(1,3-benzodioxol-5-ylmethylamino)-5-(dimethylsulfamoyl)benzamide Traditional Name: N-(2-acetamidoethyl)-3-(dimethylsulfamoyl)-5-(piperonylamino)benzamide Formula: C21H26N4O6S MolecularWeight: 462.51934

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCNC(=O)C1=CC(=CC(=C1)S(=O)(=O)N(C)C)NCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC(=O)NCCNC(=O)C1=CC(=CC(=C1)S(=O)(=O)N(C)C)NCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C21H26N4O6S/c1-14(26)22-6-7-23-21(27)16-9-17(11-18(10-16)32(28,29)25(2)3)24-12-15-4-5-19-20(8-15)31-13-30-19/h4-5,8-11,24H,6-7,12-13H2,1-3H3,(H,22,26)(H,23,27)