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Details

Stereochemistry ABSOLUTE
Molecular Formula C13H14F2N4OS
Molecular Weight 312.338
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-(2,5-Difluorophenyl)-3-hydroxy-2-methyl-4-(1H-1,2,4-triazol-1-yl)butanethioamide, (2S,3R)-

SMILES

C[C@H](C(N)=S)[C@](O)(CN1C=NC=N1)C2=CC(F)=CC=C2F

InChI

InChIKey=UWVOPVUWKIHGRF-AMIZOPFISA-N
InChI=1S/C13H14F2N4OS/c1-8(12(16)21)13(20,5-19-7-17-6-18-19)10-4-9(14)2-3-11(10)15/h2-4,6-8,20H,5H2,1H3,(H2,16,21)/t8-,13-/m1/s1

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
3-(2,5-Difluorophenyl)-3-hydroxy-2-methyl-4-(1H-1,2,4-triazol-1-yl)butanethioamide, (2S,3R)-
Systematic Name English
(2S,3R)-3-(2,5-Difluorophenyl)-3-hydroxy-2-methyl-4-(1H-1,2,4-triazol-1-yl)butanethioamide
Preferred Name English
1H-1,2,4-Triazole-1-butanethioamide, ?-(2,5-difluorophenyl)-?-hydroxy-?-methyl-, (?S,?R)-
Systematic Name English
(?S,?R)-?-(2,5-Difluorophenyl)-?-hydroxy-?-methyl-1H-1,2,4-triazole-1-butanethioamide
Systematic Name English
?-(2,5-Difluorophenyl)-?-hydroxy-?-methyl-1H-1,2,4-triazole-1-butanethioamide, (?S,?R)-
Systematic Name English
Code System Code Type Description
FDA UNII
492VA7U4QF
Created by admin on Wed Apr 02 17:58:19 GMT 2025 , Edited by admin on Wed Apr 02 17:58:19 GMT 2025
PRIMARY
CAS
2170932-49-5
Created by admin on Wed Apr 02 17:58:19 GMT 2025 , Edited by admin on Wed Apr 02 17:58:19 GMT 2025
PRIMARY
PUBCHEM
124565100
Created by admin on Wed Apr 02 17:58:19 GMT 2025 , Edited by admin on Wed Apr 02 17:58:19 GMT 2025
PRIMARY
NIH
NCATS
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