SUNITINIB N-OXIDE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C22H27FN4O3
Molecular Weight	414.4732
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CCN(=O)(CC)CCNC(=O)C1=C(C)NC(\C=C2/C(=O)NC3=CC=C(F)C=C23)=C1C

InChI

InChIKey=DNCVCKYIYMUMFC-ATVHPVEESA-N

InChI=1S/C22H27FN4O3/c1-5-27(30,6-2)10-9-24-22(29)20-13(3)19(25-14(20)4)12-17-16-11-15(23)7-8-18(16)26-21(17)28/h7-8,11-12,25H,5-6,9-10H2,1-4H3,(H,24,29)(H,26,28)/b17-12-

HIDE SMILES / InChI

Molecular Formula	C22H27FN4O3
Molecular Weight	414.4732
Charge	0
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	1
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 20:13:21 GMT 2023` Edited by `admin` on `Fri Dec 15 20:13:21 GMT 2023`
Record UNII	UZ2R9A2TLL
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

SUNITINIB N-OXIDE

Common Name

English

1H-PYRROLE-3-CARBOXAMIDE, N-(2-(DIETHYLOXIDOAMINO)ETHYL)-5-((Z)-(5-FLUORO-1,2-DIHYDRO-2-OXO-3H-INDOL-3-YLIDENE)METHYL)-2,4-DIMETHYL-

Systematic Name

English

SUNITINIB METABOLITE M2E

Common Name

English

SU-012487

Code

English

5-(5-FLUORO-2-OXO-1,2-DIHYDROINDOL-(3Z)-YLIDENEMETHYL)-2,4-DIMETHYL-1H-PYRROLE-3-CARBOXYLIC ACID (2-DIETHYL-N-OXOAMINOETHYL)AMIDE

Common Name

English

N-(2-(DIETHYLOXIDOAMINO)ETHYL)-5-((Z)-(5-FLUORO-1,2-DIHYDRO-2-OXO-3H-INDOL-3-YLIDENE)METHYL)-2,4-DIMETHYL-1H-PYRROLE-3-CARBOXAMIDE

Systematic Name

English

Code System Code Type Description

CAS

356068-99-0

Created by admin on Fri Dec 15 20:13:21 GMT 2023 , Edited by admin on Fri Dec 15 20:13:21 GMT 2023

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FDA UNII

UZ2R9A2TLL

Created by admin on Fri Dec 15 20:13:21 GMT 2023 , Edited by admin on Fri Dec 15 20:13:21 GMT 2023

PRIMARY

PUBCHEM

10273227

Created by admin on Fri Dec 15 20:13:21 GMT 2023 , Edited by admin on Fri Dec 15 20:13:21 GMT 2023

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Related Record Type Details


					V99T50803M

SUNITINIB

PARENT -> METABOLITE INACTIVE

Interaction Type:

MINOR

Qualification:

PLASMA; URINE