2-[[(5Z)-5-(3,5-dibromo-6-oxocyclohexa-2,4-dien-1-ylidene)-4-(4-methylphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(phenylcarbamoyl)acetamide

Modify Date: 2025-08-28 16:52:55

2-[[(5Z)-5-(3,5-dibromo-6-oxocyclohexa-2,4-dien-1-ylidene)-4-(4-methylphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(phenylcarbamoyl)acetamide Structure
2-[[(5Z)-5-(3,5-dibromo-6-oxocyclohexa-2,4-dien-1-ylidene)-4-(4-methylphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(phenylcarbamoyl)acetamide structure
 Common Name 2-[[(5Z)-5-(3,5-dibromo-6-oxocyclohexa-2,4-dien-1-ylidene)-4-(4-methylphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(phenylcarbamoyl)acetamide
CAS Number 97399-34-3 Molecular Weight 617.31200
Density N/A Boiling Point N/A
Molecular Formula C24H19Br2N5O3S Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name 2-[[(5Z)-5-(3,5-dibromo-6-oxocyclohexa-2,4-dien-1-ylidene)-4-(4-methylphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(phenylcarbamoyl)acetamide
Synonym More Synonyms

 Chemical & Physical Properties

Molecular Formula C24H19Br2N5O3S
Molecular Weight 617.31200
Exact Mass 614.95800
PSA 141.16000
LogP 5.37520

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
AB6324000
CHEMICAL NAME :
Acetamide, 2-((5-(3,5-dibromo-2-hydroxyphenyl)-4-(4-methylphenyl )-4H-1,2,4-triazol-3- yl) thio)-N-((phenylamino)carbonyl)-
CAS REGISTRY NUMBER :
97399-34-3
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C24-H19-Br2-N5-O3-S
MOLECULAR WEIGHT :
617.36

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
>1 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
EJMCA5 European Journal of Medicinal Chemistry--Chimie Therapeutique. (Editions Scientifiques Elsevier, 29 rue Buffon, F-75005, Paris, France) V.9- 1974- Volume(issue)/page/year: 20,190,1985

 Synthetic Route

N/A structure

N/A

CAS#:97399-41-2

2-Chloro-N-(phenylcarbamoyl)acetamide structure

2-Chloro-N-(phe...

CAS#:4791-23-5

~35%

2-[[(5Z)-5-(3,5-dibromo-6-oxocyclohexa-2,4-dien-1-ylidene)-4-(4-methylphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(phenylcarbamoyl)acetamide Structure

2-[[(5Z)-5-(3,5...

CAS#:97399-34-3

Literature: Soni; Bhalla; Gupta; et al. European Journal of Medicinal Chemistry, 1985 , vol. 20, # 2 p. 190 - 192
methyl 3,5-dibromo-2-hydroxybenzoate structure

methyl 3,5-dibr...

CAS#:21702-79-4

~%

2-[[(5Z)-5-(3,5-dibromo-6-oxocyclohexa-2,4-dien-1-ylidene)-4-(4-methylphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(phenylcarbamoyl)acetamide Structure

2-[[(5Z)-5-(3,5...

CAS#:97399-34-3

Literature: Soni; Bhalla; Gupta; et al. European Journal of Medicinal Chemistry, 1985 , vol. 20, # 2 p. 190 - 192
3,5-dibromosalicylhydrazide structure

3,5-dibromosali...

CAS#:46155-70-8

~%

2-[[(5Z)-5-(3,5-dibromo-6-oxocyclohexa-2,4-dien-1-ylidene)-4-(4-methylphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(phenylcarbamoyl)acetamide Structure

2-[[(5Z)-5-(3,5...

CAS#:97399-34-3

Literature: Soni; Bhalla; Gupta; et al. European Journal of Medicinal Chemistry, 1985 , vol. 20, # 2 p. 190 - 192
N/A structure

N/A

CAS#:94493-97-7

~%

2-[[(5Z)-5-(3,5-dibromo-6-oxocyclohexa-2,4-dien-1-ylidene)-4-(4-methylphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(phenylcarbamoyl)acetamide Structure

2-[[(5Z)-5-(3,5...

CAS#:97399-34-3

Literature: Soni; Bhalla; Gupta; et al. European Journal of Medicinal Chemistry, 1985 , vol. 20, # 2 p. 190 - 192
Methyl salicylate structure

Methyl salicylate

CAS#:119-36-8

~%

2-[[(5Z)-5-(3,5-dibromo-6-oxocyclohexa-2,4-dien-1-ylidene)-4-(4-methylphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(phenylcarbamoyl)acetamide Structure

2-[[(5Z)-5-(3,5...

CAS#:97399-34-3

Literature: Soni; Bhalla; Gupta; et al. European Journal of Medicinal Chemistry, 1985 , vol. 20, # 2 p. 190 - 192

 Synonyms

Acetamide,2-((5-(3,5-dibromo-2-hydroxyphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl)thio)-N-((phenylamino)carbonyl)
LS-8812
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Chemsrc provides CAS#:97399-34-3 MSDS, density, melting point, boiling point, structure, etc. Its name is 2-[[(5Z)-5-(3,5-dibromo-6-oxocyclohexa-2,4-dien-1-ylidene)-4-(4-methylphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(phenylcarbamoyl)acetamide>> amp version: 2-[[(5Z)-5-(3,5-dibromo-6-oxocyclohexa-2,4-dien-1-ylidene)-4-(4-methylphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(phenylcarbamoyl)acetamide

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