(5-((1H-1,2,4-Triazol-1-yl)methyl)-5-(2,4-difluorophenyl)tetrahydrofuran-3-yl)methyl 4-methylbenzenesulfonate, (3R,5S)-

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C21H21F2N3O4S
Molecular Weight	449.471
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of (5-((1H-1,2,4-Triazol-1-yl)methyl)-5-(2,4-difluorophenyl)tetrahydrofuran-3-yl)methyl 4-methylbenzenesulfonate, (3R,5S)-

Structure Search

SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC[C@H]2CO[C@@](CN3C=NC=N3)(C2)C4=CC=C(F)C=C4F

InChI

InChIKey=DFWVLCJRFGIRAK-IIBYNOLFSA-N

InChI=1S/C21H21F2N3O4S/c1-15-2-5-18(6-3-15)31(27,28)30-11-16-9-21(29-10-16,12-26-14-24-13-25-26)19-7-4-17(22)8-20(19)23/h2-8,13-14,16H,9-12H2,1H3/t16-,21-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C21H21F2N3O4S
Molecular Weight	449.471
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	2 / 2
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 17:01:46 GMT 2025` Edited by `admin` on `Wed Apr 02 17:01:46 GMT 2025`
Record UNII	E8Q8PUD9NC
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

(5-((1H-1,2,4-Triazol-1-yl)methyl)-5-(2,4-difluorophenyl)tetrahydrofuran-3-yl)methyl 4-methylbenzenesulfonate, (3R,5S)-

Systematic Name

English

((3R,5S)-5-((1H-1,2,4-Triazol-1-yl)methyl)-5-(2,4-difluorophenyl)tetrahydrofuran-3-yl)methyl 4-methylbenzenesulfonate

Preferred Name

English

2,5-Anhydro-1,3,4-trideoxy-2-C-(2,4-difluorophenyl)-4-[[[(4-methylphenyl)sulfonyl]oxy]methyl]-1-(1H-1,2,4-triazol-1-yl)-L-threo-pentitol

Systematic Name

English

[(3R,5S)-5-(2,4-difluorophenyl)-5-(1,2,4-triazol-1-ylmethyl)tetrahydrofuran-3-yl]methyl 4-methylbenzenesulfonate

Systematic Name

English

L-threo-Pentitol, 2,5-anhydro-1,3,4-trideoxy-2-C-(2,4-difluorophenyl)-4-[[[(4-methylphenyl)sulfonyl]oxy]methyl]-1-(1H-1,2,4-triazol-1-yl)-

Systematic Name

English

Code System Code Type Description

CAS

149809-42-7

Created by admin on Wed Apr 02 17:01:46 GMT 2025 , Edited by admin on Wed Apr 02 17:01:46 GMT 2025

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FDA UNII

E8Q8PUD9NC

Created by admin on Wed Apr 02 17:01:46 GMT 2025 , Edited by admin on Wed Apr 02 17:01:46 GMT 2025

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PUBCHEM

11762142

Created by admin on Wed Apr 02 17:01:46 GMT 2025 , Edited by admin on Wed Apr 02 17:01:46 GMT 2025

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(5-((1H-1,2,4-Triazol-1-yl)methyl)-5-(2,4-difluorophenyl)tetrahydrofuran-3-yl)methyl 4-methylbenzenesulfonate, (3S,5R)-

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