(4-(3-(2-Chlorobenzoyl)-5-ethylthiophen-2-yl)-5-methyl[1,2,4]triazol-3-ylmethyl)-3,4-dichlorobenzoate

HCID 19085140
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Basic information

Standard SMILES
CCc1cc(C(=O)c2ccccc2Cl)c(-n2c(C)nnc2COC(=O)c2ccc(Cl)c(Cl)c2)s1
InChIKey
QUEOYNQGOUSWJK-UHFFFAOYSA-N
Molecular formula
C24H18Cl3N3O3S
Average molar mass
534.8 g/mol

Names & identifiers

Preferred name
(4-(3-(2-Chlorobenzoyl)-5-ethylthiophen-2-yl)-5-methyl[1,2,4]triazol-3-ylmethyl)-3,4-dichlorobenzoate
IUPAC
[4-[3-(2-chlorobenzoyl)-5-ethylthiophen-2-yl]-5-methyl-1,2,4-triazol-3-yl]methyl 3,4-dichlorobenzoate

Names & synonyms

SCHEMBL8692013QUEOYNQGOUSWJK-UHFFFAOYSA-N(4-(3-(2-chlorobenzoyl)-5-ethylthiophen-2-yl)-5-methyl[1,2,4]triazol-3-ylmethyl)-3,4-dichlorobenzoate

Database identifiers

PubChem CID
19085140

Properties

Computed structural properties

XLogP
6.9
Topological polar surface area
102 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
6
Rotatable bonds
8
Heavy atoms
34

Related reactions

2 records
New reaction record

Compound notes

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