4-[5-(2,4-Difluorophenyl)-5-[1,2,4]triazol-1-ylmethyltetrahydrofuran-3-ylmethyl]methoxy-formanilide, (5R-cis)-

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C21H20F2N4O3
Molecular Weight	414.4053
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 4-[5-(2,4-Difluorophenyl)-5-[1,2,4]triazol-1-ylmethyltetrahydrofuran-3-ylmethyl]methoxy-formanilide, (5R-cis)-

Structure Search

SMILES

FC1=CC=C(C(F)=C1)[C@@]3(CN2C=NC=N2)C[C@H](COC4=CC=C(NC=O)C=C4)CO3

InChI

InChIKey=FCASVHIAWJZBAQ-VFNWGFHPSA-N

InChI=1S/C21H20F2N4O3/c22-16-1-6-19(20(23)7-16)21(11-27-13-24-12-26-27)8-15(10-30-21)9-29-18-4-2-17(3-5-18)25-14-28/h1-7,12-15H,8-11H2,(H,25,28)/t15-,21+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C21H20F2N4O3
Molecular Weight	414.4053
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 17:55:49 GMT 2025` Edited by `admin` on `Wed Apr 02 17:55:49 GMT 2025`
Record UNII	X88DWG4AM2
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Posaconazole Impurity D

Preferred Name

English

4-[5-(2,4-Difluorophenyl)-5-[1,2,4]triazol-1-ylmethyltetrahydrofuran-3-ylmethyl]methoxy-formanilide, (5R-cis)-

Systematic Name

English

D-threo-Pentitol, 2,5-anhydro-1,3,4-trideoxy-2-C-(2,4-difluorophenyl)-4-[[4-(formylamino)phenoxy]methyl]-1-(1H-1,2,4-triazol-1-yl)-

Systematic Name

English

2,5-Anhydro-1,3,4-trideoxy-2-C-(2,4-difluorophenyl)-4-[[4-(formylamino)phenoxy]methyl]-1-(1H-1,2,4-triazol-1-yl)-D-threo-pentitol

Systematic Name

English

(5R-cis)-4-[5-(2,4-Difluorophenyl)-5-[1,2,4]triazol-1-ylmethyltetrahydrofuran-3-ylmethyl]methoxy-formanilide

Systematic Name

English

Code System Code Type Description

CAS

357189-97-0

Created by admin on Wed Apr 02 17:55:49 GMT 2025 , Edited by admin on Wed Apr 02 17:55:49 GMT 2025

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PUBCHEM

101117213

Created by admin on Wed Apr 02 17:55:49 GMT 2025 , Edited by admin on Wed Apr 02 17:55:49 GMT 2025

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FDA UNII

X88DWG4AM2

Created by admin on Wed Apr 02 17:55:49 GMT 2025 , Edited by admin on Wed Apr 02 17:55:49 GMT 2025

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