EXO-DEHYDRO-PIMAVANSERIN

Details

Stereochemistry	ACHIRAL
Molecular Formula	C25H32FN3O2
Molecular Weight	425.5389
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CN1CCC(CC1)N(CC2=CC=C(F)C=C2)C(=O)NCC3=CC=C(OCC(C)=C)C=C3

InChI

InChIKey=ZPSIMBGXXJZQNF-UHFFFAOYSA-N

InChI=1S/C25H32FN3O2/c1-19(2)18-31-24-10-6-20(7-11-24)16-27-25(30)29(23-12-14-28(3)15-13-23)17-21-4-8-22(26)9-5-21/h4-11,23H,1,12-18H2,2-3H3,(H,27,30)

HIDE SMILES / InChI

Molecular Formula	C25H32FN3O2
Molecular Weight	425.5389
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 15:11:41 UTC 2023` Edited by `admin` on `Sat Dec 16 15:11:41 UTC 2023`
Record UNII	4E85SPA42S
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

EXO-DEHYDRO-PIMAVANSERIN

Common Name

English

UREA, N-((4-FLUOROPHENYL)METHYL)-N-(1-METHYL-4-PIPERIDINYL)-N'-((4-((2-METHYL-2-PROPEN-1-YL)OXY)PHENYL)METHYL)-

Systematic Name

English

AC-356

Code

English

PIMAVANSERIN METABOLITE (AC-271356)

Common Name

English

AC-271356

Code

English

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

Systematic Name

English

Code System Code Type Description

PUBCHEM

46935340

Created by admin on Sat Dec 16 15:11:41 UTC 2023 , Edited by admin on Sat Dec 16 15:11:41 UTC 2023

PRIMARY

FDA UNII

4E85SPA42S

Created by admin on Sat Dec 16 15:11:41 UTC 2023 , Edited by admin on Sat Dec 16 15:11:41 UTC 2023

PRIMARY

CAS

1246458-13-8

Created by admin on Sat Dec 16 15:11:41 UTC 2023 , Edited by admin on Sat Dec 16 15:11:41 UTC 2023

PRIMARY

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PIMAVANSERIN

PARENT -> METABOLITE