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

Systemtic Name: N-[5-(2-chloranyl-5-methoxy-phenoxy)-2-(2-methoxyethyl)-4-oxidanylidene-1H-pyrimidin-6-yl]-1,3-benzodioxole-5-sulfonamide Openeye Name: N-[5-(2-chloro-5-methoxy-phenoxy)-2-(2-methoxyethyl)-4-oxo-1H-pyrimidin-6-yl]-1,3-benzodioxole-5-sulfonamide CAS Name: N-[5-(2-chloro-5-methoxyphenoxy)-2-(2-methoxyethyl)-4-oxo-1H-pyrimidin-6-yl]-1,3-benzodioxole-5-sulfonamide IUPAC Name: N-[5-(2-chloro-5-methoxyphenoxy)-2-(2-methoxyethyl)-4-oxo-1H-pyrimidin-6-yl]-1,3-benzodioxole-5-sulfonamide Traditional Name: N-[5-(2-chloro-5-methoxy-phenoxy)-4-keto-2-(2-methoxyethyl)-1H-pyrimidin-6-yl]-1,3-benzodioxole-5-sulfonamide Formula: C21H20ClN3O8S MolecularWeight: 509.9168

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCC1=NC(=O)C(=C(N1)NS(=O)(=O)C2=CC3=C(C=C2)OCO3)OC4=C(C=CC(=C4)OC)Cl

Isomeric SMILES

COCCC1=NC(=O)C(=C(N1)NS(=O)(=O)C2=CC3=C(C=C2)OCO3)OC4=C(C=CC(=C4)OC)Cl

InChI

InChI=1S/C21H20ClN3O8S/c1-29-8-7-18-23-20(25-34(27,28)13-4-6-15-17(10-13)32-11-31-15)19(21(26)24-18)33-16-9-12(30-2)3-5-14(16)22/h3-6,9-10H,7-8,11H2,1-2H3,(H2,23,24,25,26)