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Details

Stereochemistry ACHIRAL
Molecular Formula C8H7N3S
Molecular Weight 177.226
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5-PHENYL-S-TRIAZOLE-3-THIOL

SMILES

SC1=NN=C(N1)C2=CC=CC=C2

InChI

InChIKey=JRLMMJNORORYPO-UHFFFAOYSA-N
InChI=1S/C8H7N3S/c12-8-9-7(10-11-8)6-4-2-1-3-5-6/h1-5H,(H2,9,10,11,12)

HIDE SMILES / InChI

Approval Year

Name Type Language
NSC-11565
Preferred Name English
5-PHENYL-S-TRIAZOLE-3-THIOL
Systematic Name English
3-MERCAPTO-5-PHENYL-1,2,4-TRIAZOLE
Systematic Name English
5-PHENYL-1,2,4-TRIAZOLE-3-THIOL
Systematic Name English
5-PHENYL-2H-1,2,4-TRIAZOLE-3-THIOL
Systematic Name English
S-TRIAZOLE-3-THIOL, 5-PHENYL-
Systematic Name English
3H-1,2,4-TRIAZOLE-3-THIONE, 1,2-DIHYDRO-5-PHENYL-
Systematic Name English
3-PHENYL-1,2,4-TRIAZOLE-5-THIOL
Systematic Name English
5-PHENYL-1H-1,2,4-TRIAZOLE-3-THIOL
Systematic Name English
3-PHENYL-5-MERCAPTO-S-TRIAZOLE
Systematic Name English
1,2-DIHYDRO-5-PHENYL-3H-1,2,4-TRIAZOLE-3-THIONE
Systematic Name English
1H-1,2,4-TRIAZOLE-3-THIOL, 5-PHENYL-
Systematic Name English
.DELTA.2-1,2,4-TRIAZOLINE-5-THIONE, 3-PHENYL-
Systematic Name English
Code System Code Type Description
PUBCHEM
698268
Created by admin on Tue Apr 01 19:47:47 GMT 2025 , Edited by admin on Tue Apr 01 19:47:47 GMT 2025
PRIMARY
FDA UNII
V3LV9TS8XD
Created by admin on Tue Apr 01 19:47:47 GMT 2025 , Edited by admin on Tue Apr 01 19:47:47 GMT 2025
PRIMARY
NSC
11565
Created by admin on Tue Apr 01 19:47:47 GMT 2025 , Edited by admin on Tue Apr 01 19:47:47 GMT 2025
PRIMARY
EPA CompTox
DTXSID80187742
Created by admin on Tue Apr 01 19:47:47 GMT 2025 , Edited by admin on Tue Apr 01 19:47:47 GMT 2025
PRIMARY
CAS
3414-94-6
Created by admin on Tue Apr 01 19:47:47 GMT 2025 , Edited by admin on Tue Apr 01 19:47:47 GMT 2025
PRIMARY