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N-[(n-butylaMino)carbonyl]-4-[(3-Methylphenyl)aMino]-3-pyridinesulfonaMide

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N-[(n-butylaMino)carbonyl]-4-[(3-Methylphenyl)aMino]-3-pyridinesulfonaMide Basic information

Product Name:
N-[(n-butylaMino)carbonyl]-4-[(3-Methylphenyl)aMino]-3-pyridinesulfonaMide
Synonyms:
  • N-[(n-butylaMino)carbonyl]-4-[(3-Methylphenyl)aMino]-3-pyridinesulfonaMide
  • TorseMide Related CoMpound B
  • Torsemide Related Compound B (75 mg) (N-[(n-butylamino)carbonyl]-4-[(3-methylphenyl)amino]-3-pyridinesulfonamide)
  • TorseMide IMpurity D
  • N-1-Butyl-1-deMethylethyl TorseMide
  • Torsemide Related Compound B (50 mg) (N-[(n-butylamino)carbonyl]-4-[(3-methylphenyl)amino]-3-pyridinesulfonamide)
  • Torasemide impurity D (EP)
  • 1-butyl-3-[4-(3-methylanilino)pyridin-3-yl]sulfonylurea
CAS:
160972-33-8
MF:
C17H22N4O3S
MW:
362.45
Mol File:
160972-33-8.mol
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N-[(n-butylaMino)carbonyl]-4-[(3-Methylphenyl)aMino]-3-pyridinesulfonaMide Chemical Properties

Melting point:
132-136°C
Density 
1.260±0.06 g/cm3(Predicted)
storage temp. 
Refrigerator, under inert atmosphere
solubility 
DMSO (Slightly), Methanol (Slightly)
pka
3.39±0.10(Predicted)
color 
White to Off-White
Major Application
pharmaceutical
InChI
1S/C17H22N4O3S/c1-3-4-9-19-17(22)21-25(23,24)16-12-18-10-8-15(16)20-14-7-5-6-13(2)11-14/h5-8,10-12H,3-4,9H2,1-2H3,(H,18,20)(H2,19,21,22)
InChIKey
YITRQCQYMPXGMU-UHFFFAOYSA-N
SMILES
CC1=CC(NC2=CC=NC=C2S(=O)(NC(NCCCC)=O)=O)=CC=C1
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Safety Information

Hazard Codes 
Xi
Risk Statements 
36
Safety Statements 
26
WGK Germany 
WGK 3
HS Code 
2935909550
Storage Class
13 - Non Combustible Solids
Hazard Classifications
Eye Irrit. 2
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N-[(n-butylaMino)carbonyl]-4-[(3-Methylphenyl)aMino]-3-pyridinesulfonaMide Usage And Synthesis

Uses

N-1-Butyl-1-demethylethyl Torsemide is an impurity of Torsemide (T548750), a diuretic.

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