1-(1,3-benzodioxol-5-ylcarbonylamino)-3-[3-(dimethylsulfamoyl)phenyl]thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylcarbonylamino)-3-[3-(dimethylsulfamoyl)phenyl]thiourea Openeye Name: 1-(1,3-benzodioxole-5-carbonylamino)-3-[3-(dimethylsulfamoyl)phenyl]thiourea CAS Name: 1-[[1,3-benzodioxol-5-yl(oxo)methyl]amino]-3-[3-(dimethylsulfamoyl)phenyl]thiourea IUPAC Name: 1-(1,3-benzodioxole-5-carbonylamino)-3-[3-(dimethylsulfamoyl)phenyl]thiourea Traditional Name: 1-[3-(dimethylsulfamoyl)phenyl]-3-(piperonyloylamino)thiourea Formula: C17H18N4O5S2 MolecularWeight: 422.47862

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=CC(=C1)NC(=S)NNC(=O)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=CC(=C1)NC(=S)NNC(=O)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C17H18N4O5S2/c1-21(2)28(23,24)13-5-3-4-12(9-13)18-17(27)20-19-16(22)11-6-7-14-15(8-11)26-10-25-14/h3-9H,10H2,1-2H3,(H,19,22)(H2,18,20,27)