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Details

Stereochemistry ACHIRAL
Molecular Formula C14H18ClN3S
Molecular Weight 295.831
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3H-1,2,4-Triazole-3-thione, 5-(3-chlorophenyl)-4-hexyl-2,4-dihydro-

SMILES

CCCCCCN1C(=S)NN=C1C2=CC(Cl)=CC=C2

InChI

InChIKey=NXVBNYCEJOUACC-UHFFFAOYSA-N
InChI=1S/C14H18ClN3S/c1-2-3-4-5-9-18-13(16-17-14(18)19)11-7-6-8-12(15)10-11/h6-8,10H,2-5,9H2,1H3,(H,17,19)

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
TP-315
Preferred Name English
3H-1,2,4-Triazole-3-thione, 5-(3-chlorophenyl)-4-hexyl-2,4-dihydro-
Systematic Name English
3-(3-chlorophenyl)-4-hexyl-4,5-dihydro-1H-1,2,4-triazole-5-thione
Systematic Name English
5-(3-Chlorophenyl)-4-hexyl-2,4-dihydro-3H-1,2,4-triazole-3-thione
Systematic Name English
Code System Code Type Description
PUBCHEM
71533169
Created by admin on Wed Apr 02 18:14:31 GMT 2025 , Edited by admin on Wed Apr 02 18:14:31 GMT 2025
PRIMARY
FDA UNII
3VY63UW3NL
Created by admin on Wed Apr 02 18:14:31 GMT 2025 , Edited by admin on Wed Apr 02 18:14:31 GMT 2025
PRIMARY
CAS
1426945-61-0
Created by admin on Wed Apr 02 18:14:31 GMT 2025 , Edited by admin on Wed Apr 02 18:14:31 GMT 2025
PRIMARY
NIH
NCATS
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