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Substance Name: Fosnetupitant chloride [USAN]
RN: 1643757-72-5
UNII: ZR36MFA9P8
InChIKey: LBTQUZNIWCWBNN-UHFFFAOYSA-M

Classification Code

  • Antiemetic

Molecular Formula

  • C31-H36-F6-N4-O5-P+.Cl-.H-Cl

Molecular Weight

  • 760.5164
 
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Names and Synonyms

Name of Substance

  • Fosnetupitant chloride [USAN]

Synonyms

  • 08-PNET
  • 4-(5-(2-(3,5-bis(trifluoromethyl)phenyl)-N,2-dimethylpropanamido)-4-(2-methylphenyl)pyridin-2-yl)-1-methyl-1-((phosphonooxy)methyl)piperazinium chloride monohydrochloride
  • Fosnetupitant chloride
  • UNII-ZR36MFA9P8

Systematic Name

  • Piperazinium, 4-(5-((2-(3,5-bis(trifluoromethyl)phenyl)-2-methyl-1-oxopropyl)methylamino)-4-(2-methylphenyl)-2-pyridinyl)-1-methyl-1-((phosphonooxy)methyl)-, chloride, hydrochloride (1:1:1)

Registry Numbers

CAS Registry Number

  • 1643757-72-5

FDA UNII

  • ZR36MFA9P8

System Generated Number

  • 1643757725

Structure Descriptors

InChI

1S/C31H35F6N4O5P.2ClH/c1-20-8-6-7-9-24(20)25-17-27(40-10-12-41(5,13-11-40)19-46-47(43,44)45)38-18-26(25)39(4)28(42)29(2,3)21-14-22(30(32,33)34)16-23(15-21)31(35,36)37;;/h6-9,14-18H,10-13,19H2,1-5H3,(H-,43,44,45);2*1H/p-1

InChIKey

LBTQUZNIWCWBNN-UHFFFAOYSA-M

Smiles

Cl.[Cl-].CN(C(=O)C(C)(C)c1cc(cc(c1)C(F)(F)F)C(F)(F)F)c2cnc(cc2c3ccccc3C)N4CC[N+](C)(COP(=O)(O)[O-])CC4