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

Systemtic Name: N-[5-(2-chloranyl-5-methoxy-phenoxy)-2-(methoxymethyl)-4-oxidanylidene-1H-pyrimidin-6-yl]-1,3-benzodioxole-5-sulfonamide Openeye Name: N-[5-(2-chloro-5-methoxy-phenoxy)-2-(methoxymethyl)-4-oxo-1H-pyrimidin-6-yl]-1,3-benzodioxole-5-sulfonamide CAS Name: N-[5-(2-chloro-5-methoxyphenoxy)-2-(methoxymethyl)-4-oxo-1H-pyrimidin-6-yl]-1,3-benzodioxole-5-sulfonamide IUPAC Name: N-[5-(2-chloro-5-methoxyphenoxy)-2-(methoxymethyl)-4-oxo-1H-pyrimidin-6-yl]-1,3-benzodioxole-5-sulfonamide Traditional Name: N-[5-(2-chloro-5-methoxy-phenoxy)-4-keto-2-(methoxymethyl)-1H-pyrimidin-6-yl]-1,3-benzodioxole-5-sulfonamide Formula: C20H18ClN3O8S MolecularWeight: 495.89022

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=NC(=O)C(=C(N1)NS(=O)(=O)C2=CC3=C(C=C2)OCO3)OC4=C(C=CC(=C4)OC)Cl

Isomeric SMILES

COCC1=NC(=O)C(=C(N1)NS(=O)(=O)C2=CC3=C(C=C2)OCO3)OC4=C(C=CC(=C4)OC)Cl

InChI

InChI=1S/C20H18ClN3O8S/c1-28-9-17-22-19(24-33(26,27)12-4-6-14-16(8-12)31-10-30-14)18(20(25)23-17)32-15-7-11(29-2)3-5-13(15)21/h3-8H,9-10H2,1-2H3,(H2,22,23,24,25)