DE(ISOBUTYL)PIMAVANSERIN

Details

Stereochemistry	ACHIRAL
Molecular Formula	C21H26FN3O2
Molecular Weight	371.4484
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(O)C=C3

InChI

InChIKey=XUKTZFSDFDUIHQ-UHFFFAOYSA-N

InChI=1S/C21H26FN3O2/c1-24-12-10-19(11-13-24)25(15-17-2-6-18(22)7-3-17)21(27)23-14-16-4-8-20(26)9-5-16/h2-9,19,26H,10-15H2,1H3,(H,23,27)

HIDE SMILES / InChI

Molecular Formula	C21H26FN3O2
Molecular Weight	371.4484
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 14:46:30 UTC 2023` Edited by `admin` on `Sat Dec 16 14:46:30 UTC 2023`
Record UNII	MQ44Y4P7R9
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

DE(ISOBUTYL)PIMAVANSERIN

Common Name

English

PIMAVANSERIN METABOLITE M18

Common Name

English

O-DESALKYL-PIMAVANSERIN

Common Name

English

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

Systematic Name

English

AC-090680

Code

English

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

Systematic Name

English

AC-527

Code

English

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

Systematic Name

English

Code System Code Type Description

CAS

1134815-53-4

Created by admin on Sat Dec 16 14:46:30 UTC 2023 , Edited by admin on Sat Dec 16 14:46:30 UTC 2023

PRIMARY

PUBCHEM

25234455

Created by admin on Sat Dec 16 14:46:30 UTC 2023 , Edited by admin on Sat Dec 16 14:46:30 UTC 2023

PRIMARY

FDA UNII

MQ44Y4P7R9

Created by admin on Sat Dec 16 14:46:30 UTC 2023 , Edited by admin on Sat Dec 16 14:46:30 UTC 2023

PRIMARY

Related Record Type Details


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PIMAVANSERIN

PARENT -> METABOLITE