N-[5-(2-chloranyl-5-methoxy-phenoxy)-2-methylsulfanyl-4-oxidanylidene-1H-pyrimidin-6-yl]-1,3-benzodioxole-5-sulfonamide

Systemtic Name: N-[5-(2-chloranyl-5-methoxy-phenoxy)-2-methylsulfanyl-4-oxidanylidene-1H-pyrimidin-6-yl]-1,3-benzodioxole-5-sulfonamide Openeye Name: N-[5-(2-chloro-5-methoxy-phenoxy)-2-methylsulfanyl-4-oxo-1H-pyrimidin-6-yl]-1,3-benzodioxole-5-sulfonamide CAS Name: N-[5-(2-chloro-5-methoxyphenoxy)-2-(methylthio)-4-oxo-1H-pyrimidin-6-yl]-1,3-benzodioxole-5-sulfonamide IUPAC Name: N-[5-(2-chloro-5-methoxyphenoxy)-2-methylsulfanyl-4-oxo-1H-pyrimidin-6-yl]-1,3-benzodioxole-5-sulfonamide Traditional Name: N-[5-(2-chloro-5-methoxy-phenoxy)-4-keto-2-(methylthio)-1H-pyrimidin-6-yl]-1,3-benzodioxole-5-sulfonamide Formula: C19H16ClN3O7S2 MolecularWeight: 497.92924

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)Cl)OC2=C(NC(=NC2=O)SC)NS(=O)(=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

COC1=CC(=C(C=C1)Cl)OC2=C(NC(=NC2=O)SC)NS(=O)(=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C19H16ClN3O7S2/c1-27-10-3-5-12(20)14(7-10)30-16-17(21-19(31-2)22-18(16)24)23-32(25,26)11-4-6-13-15(8-11)29-9-28-13/h3-8H,9H2,1-2H3,(H2,21,22,23,24)