CAS
166196-67-4 Purity
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166196-67-4 Purity
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4-Phenyl-5-pyridin-4-yl-4H-[1,2,4]triazole-3-thiol
CAS
16629-40-6
Catalog Number
ACM16629406
Category
Other Products
Molecular Weight
254.32
Molecular Formula
C13H10N4S
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Specification
Synonyms
4-Phenyl-5-pyridin-4-yl-4H-[1,2,4]triazole-3-thiol, 16629-40-6, 4-phenyl-5-(4-pyridyl)-1,2,4-triazole-3-thiol, 4-phenyl-5-(pyridin-4-yl)-4H-1,2,4-triazole-3-thiol, AC1LEHGB, BAS 01377634, AC1Q7GIU, CBMicro_025273, SureCN1104414, CHEMBL475374, MolPort-000-749-918, MolPort-000-869-377, BB_SC-1403, HTS11930, BBL008348, CCG-12291, SBB004454, STK260107, STK396962, AKOS000266766
IUPAC Name
4-phenyl-3-pyridin-4-yl-1H-1,2,4-triazole-5-thione
Canonical SMILES
C1=CC=C(C=C1)N2C(=NNC2=S)C3=CC=NC=C3
InChI Key
KPJBNFINSPXEGF-UHFFFAOYSA-N
Boiling Point
389.8ºC at 760mmHg
Flash Point
189.6ºC
Density
1.33g/cm³
Exact Mass
254.06300
H-Bond Acceptor
3
H-Bond Donor
1
Upstream Synthesis Route 1
- 6954-50-3
- 16629-40-6
Reference: [1]Sung; Lee
[Journal of Heterocyclic Chemistry, 1992, vol. 29, # 5, p. 1101 - 1109]
Downstream Synthesis Route 1
- 22539-55-5
- 16629-40-6
- 87236-39-3
Reference: [1]Pharmaceutical Chemistry Journal,1983,vol. 17,p. 476 - 479
Khimiko-Farmatsevticheskii Zhurnal,1983,vol. 17,p. 798 - 801
Downstream Synthesis Route 2
- 2564-07-0
- 16629-40-6
- 113518-54-0
Reference: [1]Indian Journal of Chemistry - Section B Organic and Medicinal Chemistry,1987,vol. 26,p. 290 - 293
* For details of the synthesis route, please refer to the original source to ensure accuracy.
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