PYRIDINE-N-OXIDE EVATANEPAG

Details

Stereochemistry	ACHIRAL
Molecular Formula	C25H28N2O6S
Molecular Weight	484.565
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of PYRIDINE-N-OXIDE EVATANEPAG

Structure Search

SMILES

CC(C)(C)C1=CC=C(CN(CC2=CC(OCC(O)=O)=CC=C2)S(=O)(=O)C3=C[N+]([O-])=CC=C3)C=C1

InChI

InChIKey=CDSQRBFQTYKJBP-UHFFFAOYSA-N

InChI=1S/C25H28N2O6S/c1-25(2,3)21-11-9-19(10-12-21)15-27(34(31,32)23-8-5-13-26(30)17-23)16-20-6-4-7-22(14-20)33-18-24(28)29/h4-14,17H,15-16,18H2,1-3H3,(H,28,29)

HIDE SMILES / InChI

Molecular Formula	C25H28N2O6S
Molecular Weight	484.565
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 16:50:00 GMT 2023` Edited by `admin` on `Sat Dec 16 16:50:00 GMT 2023`
Record UNII	IS7VQ3339K
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

PYRIDINE-N-OXIDE EVATANEPAG

Common Name

English

2-(3-((((4-(1,1-DIMETHYLETHYL)PHENYL)METHYL)((1-OXIDO-3-PYRIDINYL)SULFONYL)AMINO)METHYL)PHENOXY)ACETIC ACID

Systematic Name

English

CP-533,536 METABOLITE M5

Common Name

English

(3-(((4-TERT-BUTYLBENZYL)(1-OXOPYRIDIN-3-YLSULFONYL)AMINO)METHYL)PHENOXY)ACETIC ACID

Systematic Name

English

ACETIC ACID, 2-(3-((((4-(1,1-DIMETHYLETHYL)PHENYL)METHYL)((1-OXIDO-3-PYRIDINYL)SULFONYL)AMINO)METHYL)PHENOXY)-

Systematic Name

English

Code System Code Type Description

CAS

574759-33-4

Created by admin on Sat Dec 16 16:50:00 GMT 2023 , Edited by admin on Sat Dec 16 16:50:00 GMT 2023

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FDA UNII

IS7VQ3339K

Created by admin on Sat Dec 16 16:50:00 GMT 2023 , Edited by admin on Sat Dec 16 16:50:00 GMT 2023

PRIMARY

PUBCHEM

10174241

Created by admin on Sat Dec 16 16:50:00 GMT 2023 , Edited by admin on Sat Dec 16 16:50:00 GMT 2023

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Related Record Type Details


					L266R6E31E

EVATANEPAG

PARENT -> METABOLITE

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