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Details

Stereochemistry ABSOLUTE
Molecular Formula C14H16FN3O2
Molecular Weight 277.2941
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-(4-fluorophenyl)-4-(hydroxymethyl)-1-(1H-1,2,4-triazol-1-yl)-D-threo-pentitol

SMILES

OC[C@@H]1CO[C@](CN2C=NC=N2)(C1)C3=CC=C(F)C=C3

InChI

InChIKey=SSXYWVPZKZMMLF-RISCZKNCSA-N
InChI=1S/C14H16FN3O2/c15-13-3-1-12(2-4-13)14(5-11(6-19)7-20-14)8-18-10-16-9-17-18/h1-4,9-11,19H,5-8H2/t11-,14+/m1/s1

HIDE SMILES / InChI

Approval Year

Unknown
139594
Name Type Language
2,5-Anhydro-1,3,4-trideoxy-2-C-(4-fluorophenyl)-4-(hydroxymethyl)-1-(1H-1,2,4-triazol-1-yl)-D-threo-pentitol
Systematic Name English
D-threo-Pentitol, 2,5-anhydro-1,3,4-trideoxy-2-C-(4-fluorophenyl)-4-(hydroxymethyl)-1-(1H-1,2,4-triazol-1-yl)-
Systematic Name English
Code System Code Type Description
FDA UNII
B52S2VT73A
Created by admin on Sat Dec 16 19:51:36 GMT 2023 , Edited by admin on Sat Dec 16 19:51:36 GMT 2023
PRIMARY
PUBCHEM
168429536
Created by admin on Sat Dec 16 19:51:36 GMT 2023 , Edited by admin on Sat Dec 16 19:51:36 GMT 2023
PRIMARY
CAS
1978305-26-8
Created by admin on Sat Dec 16 19:51:36 GMT 2023 , Edited by admin on Sat Dec 16 19:51:36 GMT 2023
PRIMARY
NIH
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