2-Fluoro-6-[[2-[[2-methoxy-4-[(methylsulfonyl)methyl]phenyl]amino]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]amino]benzamide

Details

Stereochemistry	ACHIRAL
Molecular Formula	C22H21FN6O4S
Molecular Weight	484.503
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2-Fluoro-6-[[2-[[2-methoxy-4-[(methylsulfonyl)methyl]phenyl]amino]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]amino]benzamide

Structure Search

SMILES

COC1=C(NC2=NC3=C(C=CN3)C(NC4=C(C(N)=O)C(F)=CC=C4)=N2)C=CC(CS(C)(=O)=O)=C1

InChI

InChIKey=VGYXXQRDIVRILX-UHFFFAOYSA-N

InChI=1S/C22H21FN6O4S/c1-33-17-10-12(11-34(2,31)32)6-7-15(17)27-22-28-20-13(8-9-25-20)21(29-22)26-16-5-3-4-14(23)18(16)19(24)30/h3-10H,11H2,1-2H3,(H2,24,30)(H3,25,26,27,28,29)

HIDE SMILES / InChI

Molecular Formula	C22H21FN6O4S
Molecular Weight	484.503
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 `Wed Apr 02 08:03:18 GMT 2025` Edited by `admin` on `Wed Apr 02 08:03:18 GMT 2025`
Record UNII	HBL3TSS9HJ
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

2-Fluoro-6-[[2-[[2-methoxy-4-[(methylsulfonyl)methyl]phenyl]amino]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]amino]benzamide

Systematic Name

English

Benzamide, 2-fluoro-6-[[2-[[2-methoxy-4-[(methylsulfonyl)methyl]phenyl]amino]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]amino]-

Preferred Name

English

Code System Code Type Description

FDA UNII

HBL3TSS9HJ

Created by admin on Wed Apr 02 08:03:18 GMT 2025 , Edited by admin on Wed Apr 02 08:03:18 GMT 2025

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CAS

1123162-87-7

Created by admin on Wed Apr 02 08:03:18 GMT 2025 , Edited by admin on Wed Apr 02 08:03:18 GMT 2025

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PUBCHEM

25113171

Created by admin on Wed Apr 02 08:03:18 GMT 2025 , Edited by admin on Wed Apr 02 08:03:18 GMT 2025

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