AC1LR8V4 structure

AC1LR8V4

3-[5-[(3-chlorophenyl)methylsulfanyl]-4-(4-ethoxyphenyl)-1,2,4-triazol-3-yl]pyridine

Also Known As: 3-[5-[(3-chlorobenzyl)sulfanyl]-4-(4-ethoxyphenyl)-4H-1,2,4-triazol-3-yl]pyridine|3-[5-[(3-chlorophenyl)methylsulfanyl]-4-(4-ethoxyphenyl)-1,2,4-triazol-3-yl]pyridine|1-{3-[(3-chlorophenyl)methylthio]-5-(3-pyridyl)(1,2,4-triazol-4-yl)}-4-ethoxyb enzene|3-(5-((3-chlorobenzyl)thio)-4-(4-ethoxyphenyl)-4H-1,2,4-triazol-3-yl)pyridine|3-{5-[(3-chlorobenzyl)sulfanyl]-4-(4-ethoxyphenyl)-4H-1,2,4-triazol-3-yl}pyridine|3-(5-{[(3-chlorophenyl)methyl]sulfanyl}-4-(4-ethoxyphenyl)-4H-1,2,4-triazol-3-yl)pyridine

CAS: 613227-40-0
Molecular Formula C22H19ClN4OS
Molecular Weight 422.0968 g/mol
LogP 5.6737
Topological Polar Surface Area 52.83 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 5
Rotatable Bonds 7
Exact Mass 422.0968
Monoisotopic Mass 422.0968
Heavy Atoms 29
Complexity 1083.6848

Chemical Identifiers

CAS Number 613227-40-0
SMILES CCOC1=CC=C(C=C1)N2C(=NN=C2SCC3=CC(=CC=C3)Cl)C4=CN=CC=C4

Product Overview

AC1LR8V4 (CAS 613227-40-0), with molecular formula C22H19ClN4OS and molecular weight 422.0968 g/mol. IUPAC: 3-[5-[(3-chlorophenyl)methylsulfanyl]-4-(4-ethoxyphenyl)-1,2,4-triazol-3-yl]pyridine.

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