2-(1,3-benzodioxol-5-yloxymethyl)-N-(4-sulfamoylphenyl)morpholine-4-carbothioamide

Systemtic Name: 2-(1,3-benzodioxol-5-yloxymethyl)-N-(4-sulfamoylphenyl)morpholine-4-carbothioamide Openeye Name: 2-(1,3-benzodioxol-5-yloxymethyl)-N-(4-sulfamoylphenyl)morpholine-4-carbothioamide CAS Name: 2-(1,3-benzodioxol-5-yloxymethyl)-N-(4-sulfamoylphenyl)-4-morpholinecarbothioamide IUPAC Name: 2-(1,3-benzodioxol-5-yloxymethyl)-N-(4-sulfamoylphenyl)morpholine-4-carbothioamide Traditional Name: 2-(1,3-benzodioxol-5-yloxymethyl)-N-(4-sulfamoylphenyl)morpholine-4-carbothioamide Formula: C19H21N3O6S2 MolecularWeight: 451.51654

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(CN1C(=S)NC2=CC=C(C=C2)S(=O)(=O)N)COC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1COC(CN1C(=S)NC2=CC=C(C=C2)S(=O)(=O)N)COC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C19H21N3O6S2/c20-30(23,24)16-4-1-13(2-5-16)21-19(29)22-7-8-25-15(10-22)11-26-14-3-6-17-18(9-14)28-12-27-17/h1-6,9,15H,7-8,10-12H2,(H,21,29)(H2,20,23,24)