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Details

Stereochemistry ACHIRAL
Molecular Formula C25H34FN3O3
Molecular Weight 443.5542
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PIMAVANSERIN N-OXIDE

SMILES

CC(C)COC1=CC=C(CNC(=O)N(CC2=CC=C(F)C=C2)C3CC[N+](C)([O-])CC3)C=C1

InChI

InChIKey=OJRCOBBRTONMAK-UHFFFAOYSA-N
InChI=1S/C25H34FN3O3/c1-19(2)18-32-24-10-6-20(7-11-24)16-27-25(30)28(17-21-4-8-22(26)9-5-21)23-12-14-29(3,31)15-13-23/h4-11,19,23H,12-18H2,1-3H3,(H,27,30)

HIDE SMILES / InChI

Molecular Formula C25H34FN3O3
Molecular Weight 443.5542
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 15:07:01 GMT 2023
Edited
by admin
on Sat Dec 16 15:07:01 GMT 2023
Record UNII
2DA75VO6C2
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PIMAVANSERIN N-OXIDE
Common Name English
AC-260285
Common Name English
PIMAVANSERIN METABOLITE M32
Common Name English
1-((4-FLUOROPHENYL)METHYL)-1-(1-HYDROXY-1-METHYL-PIPERIDIN-1-IUM-4-YL)-3-((4-ISOBUTOXYPHENYL)METHYL)UREA
Systematic Name English
AC-285
Common Name English
UREA, N-((4-FLUOROPHENYL)METHYL)-N-(1-METHYL-1-OXIDO-4-PIPERIDINYL)-N'-((4-(2-METHYLPROPOXY)PHENYL)METHYL)-
Systematic Name English
Code System Code Type Description
FDA UNII
2DA75VO6C2
Created by admin on Sat Dec 16 15:07:01 GMT 2023 , Edited by admin on Sat Dec 16 15:07:01 GMT 2023
PRIMARY
CAS
1134815-71-6
Created by admin on Sat Dec 16 15:07:01 GMT 2023 , Edited by admin on Sat Dec 16 15:07:01 GMT 2023
PRIMARY
PUBCHEM
87619654
Created by admin on Sat Dec 16 15:07:01 GMT 2023 , Edited by admin on Sat Dec 16 15:07:01 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> METABOLITE