AC-90679

Details

Stereochemistry	ACHIRAL
Molecular Formula	C22H28FN3O2
Molecular Weight	385.475
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

COC1=CC=C(CNC(=O)N(CC2=CC=C(F)C=C2)C3CCN(C)CC3)C=C1

InChI

InChIKey=MLEABXFVMFPOFF-UHFFFAOYSA-N

InChI=1S/C22H28FN3O2/c1-25-13-11-20(12-14-25)26(16-18-3-7-19(23)8-4-18)22(27)24-15-17-5-9-21(28-2)10-6-17/h3-10,20H,11-16H2,1-2H3,(H,24,27)

HIDE SMILES / InChI

Molecular Formula	C22H28FN3O2
Molecular Weight	385.475
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 14:41:48 GMT 2023` Edited by `admin` on `Sat Dec 16 14:41:48 GMT 2023`
Record UNII	GFQ3G4K6JH
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

AC-90679

Code

English

N-((4-FLUOROPHENYL)METHYL)-N'-((4-METHOXYPHENYL)METHYL)-N-(1-METHYL-4-PIPERIDINYL)UREA

Systematic Name

English

1-((4-FLUOROPHENYL)METHYL)-3-((4-METHOXYPHENYL)METHYL)-1-(1-METHYL-4-PIPERIDYL)UREA

Systematic Name

English

O-DE(ISOBUTYL)-O-METHYL PIMAVANSERIN

Common Name

English

PIMAVANSERIN METABOLITE (AC-90679)

Common Name

English

UREA, N-((4-FLUOROPHENYL)METHYL)-N'-((4-METHOXYPHENYL)METHYL)-N-(1-METHYL-4-PIPERIDINYL)-

Systematic Name

English

Code System Code Type Description

CAS

1134815-56-7

Created by admin on Sat Dec 16 14:41:48 GMT 2023 , Edited by admin on Sat Dec 16 14:41:48 GMT 2023

PRIMARY

FDA UNII

GFQ3G4K6JH

Created by admin on Sat Dec 16 14:41:48 GMT 2023 , Edited by admin on Sat Dec 16 14:41:48 GMT 2023

PRIMARY

PUBCHEM

57625338

Created by admin on Sat Dec 16 14:41:48 GMT 2023 , Edited by admin on Sat Dec 16 14:41:48 GMT 2023

PRIMARY

Related Record Type Details


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PIMAVANSERIN

PARENT -> METABOLITE