N-DEMETHYLPIMAVANSERIN, (DE(O-ISOBUTYL)-O-(2-HYDROXY-ISOBUTYL))-

Details

Stereochemistry	ACHIRAL
Molecular Formula	C24H32FN3O3
Molecular Weight	429.5276
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of N-DEMETHYLPIMAVANSERIN, (DE(O-ISOBUTYL)-O-(2-HYDROXY-ISOBUTYL))-

Structure Search

SMILES

CC(C)(O)COC1=CC=C(CNC(=O)N(CC2=CC=C(F)C=C2)C3CCNCC3)C=C1

InChI

InChIKey=BXOLVUFMOMRAKV-UHFFFAOYSA-N

InChI=1S/C24H32FN3O3/c1-24(2,30)17-31-22-9-5-18(6-10-22)15-27-23(29)28(21-11-13-26-14-12-21)16-19-3-7-20(25)8-4-19/h3-10,21,26,30H,11-17H2,1-2H3,(H,27,29)

HIDE SMILES / InChI

Molecular Formula	C24H32FN3O3
Molecular Weight	429.5276
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 15:03:33 UTC 2023` Edited by `admin` on `Sat Dec 16 15:03:33 UTC 2023`
Record UNII	3L7Z38BL67
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

N-DEMETHYLPIMAVANSERIN, (DE(O-ISOBUTYL)-O-(2-HYDROXY-ISOBUTYL))-

Common Name

English

1-((4-FLUOROPHENYL)METHYL)-3-((4-(2-HYDROXY-2-METHYL-PROPOXY)PHENYL)METHYL)-1-(4-PIPERIDYL)UREA

Common Name

English

PIMAVANSERIN METABOLITE M25

Common Name

English

Code System Code Type Description

FDA UNII

3L7Z38BL67

Created by admin on Sat Dec 16 15:03:33 UTC 2023 , Edited by admin on Sat Dec 16 15:03:33 UTC 2023

PRIMARY

PUBCHEM

138319985

Created by admin on Sat Dec 16 15:03:33 UTC 2023 , Edited by admin on Sat Dec 16 15:03:33 UTC 2023

PRIMARY

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PIMAVANSERIN

PARENT -> METABOLITE