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Reference substances

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IUPAC name:
sodium 4,6-dimethoxy-N-({[3-(2,2,2-trifluoroethoxy)pyridin-2-yl]sulfonyl}carbamoyl)pyrimidin-2-aminide

Inventory

CAS number:
199119-58-9
Synonyms
Names:
2-Pyridinesulfonamide, N-[[(4,6-dimethoxy-2-pyrimidinyl)amino]carbonyl]-3-(2,2,2-trifluoroethoxy)-, sodium salt (1:1)
sodium (4,6-dimethoxypyrimidin-2-yl)carbamoyl-[[3-(2,2,2-trifluoroethoxy)-2-pyridyl]sulfonyl]azanide

Molecular and structural information

Molecular formula:
C14H13F3N5O6SNa
Molecular weight:
459.333
SMILES notation:
COc1cc(nc(n1)NC(=O)[N-]S(=O)(=O)c2c(cccn2)OCC(F)(F)F)OC.[Na+]
InChl:
InChI=1S/C14H14F3N5O6S.Na/c1-26-9-6-10(27-2)20-12(19-9)21-13(23)22-29(24,25)11-8(4-3-5-18-11)28-7-14(15,16)17;/h3-6H,7H2,1-2H3,(H2,19,20,21,22,23);/q;+1/p-1
Structural formula:
Chemical structure

Related substances

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CAS number
Identity:
199119-58-9