1-(1,3-benzodioxol-5-yl)-3-[2-(methylsulfonylamino)-1,3-benzothiazol-6-yl]urea

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-3-[2-(methylsulfonylamino)-1,3-benzothiazol-6-yl]urea Openeye Name: 1-(1,3-benzodioxol-5-yl)-3-[2-(methanesulfonamido)-1,3-benzothiazol-6-yl]urea CAS Name: 1-(1,3-benzodioxol-5-yl)-3-[2-(methanesulfonamido)-1,3-benzothiazol-6-yl]urea IUPAC Name: 1-(1,3-benzodioxol-5-yl)-3-[2-(methanesulfonamido)-1,3-benzothiazol-6-yl]urea Traditional Name: 1-(1,3-benzodioxol-5-yl)-3-[2-(methanesulfonamido)-1,3-benzothiazol-6-yl]urea Formula: C16H14N4O5S2 MolecularWeight: 406.43616

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=NC2=C(S1)C=C(C=C2)NC(=O)NC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CS(=O)(=O)NC1=NC2=C(S1)C=C(C=C2)NC(=O)NC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C16H14N4O5S2/c1-27(22,23)20-16-19-11-4-2-10(7-14(11)26-16)18-15(21)17-9-3-5-12-13(6-9)25-8-24-12/h2-7H,8H2,1H3,(H,19,20)(H2,17,18,21)