1-(1,3-benzodioxol-5-yl)-3-[(2,5-dimethoxyphenyl)sulfonylamino]thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-3-[(2,5-dimethoxyphenyl)sulfonylamino]thiourea Openeye Name: 1-(1,3-benzodioxol-5-yl)-3-[(2,5-dimethoxyphenyl)sulfonylamino]thiourea CAS Name: 1-(1,3-benzodioxol-5-yl)-3-[(2,5-dimethoxyphenyl)sulfonylamino]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-yl)-3-[(2,5-dimethoxyphenyl)sulfonylamino]thiourea Traditional Name: 1-(1,3-benzodioxol-5-yl)-3-[(2,5-dimethoxyphenyl)sulfonylamino]thiourea Formula: C16H17N3O6S2 MolecularWeight: 411.45268

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)S(=O)(=O)NNC(=S)NC2=CC3=C(C=C2)OCO3

Isomeric SMILES

COC1=CC(=C(C=C1)OC)S(=O)(=O)NNC(=S)NC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C16H17N3O6S2/c1-22-11-4-6-13(23-2)15(8-11)27(20,21)19-18-16(26)17-10-3-5-12-14(7-10)25-9-24-12/h3-8,19H,9H2,1-2H3,(H2,17,18,26)