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

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

Systemtic Name:N-[5-(2-chloranyl-5-methoxy-phenoxy)-2-(4-methoxyphenyl)-4-oxidanylidene-1H-pyrimidin-6-yl]-1,3-benzodioxole-5-sulfonamide
Openeye Name:N-[5-(2-chloro-5-methoxy-phenoxy)-2-(4-methoxyphenyl)-4-oxo-1H-pyrimidin-6-yl]-1,3-benzodioxole-5-sulfonamide
CAS Name:N-[5-(2-chloro-5-methoxyphenoxy)-2-(4-methoxyphenyl)-4-oxo-1H-pyrimidin-6-yl]-1,3-benzodioxole-5-sulfonamide
IUPAC Name:N-[5-(2-chloro-5-methoxyphenoxy)-2-(4-methoxyphenyl)-4-oxo-1H-pyrimidin-6-yl]-1,3-benzodioxole-5-sulfonamide
Traditional Name:N-[5-(2-chloro-5-methoxy-phenoxy)-4-keto-2-(4-methoxyphenyl)-1H-pyrimidin-6-yl]-1,3-benzodioxole-5-sulfonamide
Formula: C25H20ClN3O8S
MolecularWeight: 557.9596
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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC(=O)C(=C(N2)NS(=O)(=O)C3=CC4=C(C=C3)OCO4)OC5=C(C=CC(=C5)OC)Cl


Isomeric SMILES

COC1=CC=C(C=C1)C2=NC(=O)C(=C(N2)NS(=O)(=O)C3=CC4=C(C=C3)OCO4)OC5=C(C=CC(=C5)OC)Cl


InChI

InChI=1S/C25H20ClN3O8S/c1-33-15-5-3-14(4-6-15)23-27-24(29-38(31,32)17-8-10-19-21(12-17)36-13-35-19)22(25(30)28-23)37-20-11-16(34-2)7-9-18(20)26/h3-12H,13H2,1-2H3,(H2,27,28,29,30)


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