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

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C30H30F2N6O4
Molecular Weight	576.5938
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

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

Structure Search

SMILES

[O-][N+](=O)C1=CC=C(C=C1)N2CCN(CC2)C3=CC=C(OC[C@@H]4CO[C@](CN5C=NC=N5)(C4)C6=CC=C(F)C=C6F)C=C3

InChI

InChIKey=MSKDCNFPYVYHAW-RCRUUEGKSA-N

InChI=1S/C30H30F2N6O4/c31-23-1-10-28(29(32)15-23)30(19-37-21-33-20-34-37)16-22(18-42-30)17-41-27-8-6-25(7-9-27)36-13-11-35(12-14-36)24-2-4-26(5-3-24)38(39)40/h1-10,15,20-22H,11-14,16-19H2/t22-,30+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C30H30F2N6O4
Molecular Weight	576.5938
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 19:24:18 GMT 2025` Edited by `admin` on `Wed Apr 02 19:24:18 GMT 2025`
Record UNII	2RR2SVF8UQ
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

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

Preferred Name

English

Code System Code Type Description

CAS

161532-52-1

Created by admin on Wed Apr 02 19:24:18 GMT 2025 , Edited by admin on Wed Apr 02 19:24:18 GMT 2025

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FDA UNII

2RR2SVF8UQ

Created by admin on Wed Apr 02 19:24:18 GMT 2025 , Edited by admin on Wed Apr 02 19:24:18 GMT 2025

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PUBCHEM

134990256

Created by admin on Wed Apr 02 19:24:18 GMT 2025 , Edited by admin on Wed Apr 02 19:24:18 GMT 2025

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