C21H23ClN4OS structure

C21H23ClN4OS

2-[[5-(3-chlorophenyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]-N-(4-propan-2-ylphenyl)acetamide

Also Known As: KS-00003MKG|JS-2742|2-{[5-(3-chlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[4-(propan-2-yl)phenyl]acetamide|2-((5-(3-Chlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl)thio)-N-(4-isopropylphenyl)acetamide|2-[[5-(3-chlorophenyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]-N-(4-propan-2-ylphenyl)acetamide|2-{[5-(3-chlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-isopropylphenyl)acetamide|2-[[5-(3-chlorophenyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]-N-(4-isopropylphenyl)acetamide

CAS: 849029-69-2
Molecular Formula C21H23ClN4OS
Molecular Weight 414.1281 g/mol
LogP 5.4726
Topological Polar Surface Area 59.81 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 4
Rotatable Bonds 7
Exact Mass 414.1281
Monoisotopic Mass 414.1281
Heavy Atoms 28
Complexity 953.2944

Chemical Identifiers

CAS Number 849029-69-2
SMILES CCN1C(=NN=C1SCC(=O)NC2=CC=C(C=C2)C(C)C)C3=CC(=CC=C3)Cl

Product Overview

C21H23ClN4OS (CAS 849029-69-2), with molecular formula C21H23ClN4OS and molecular weight 414.1281 g/mol. IUPAC: 2-[[5-(3-chlorophenyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]-N-(4-propan-2-ylphenyl)acetamide.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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