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2-(4-methanesulfonyl-phenyl)-3-(2-oxo-cyclopentyl)-N-thiazol-2-yl-propionamide

HCID 10340494
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
CS(=O)(=O)c1ccc(C(CC2CCCC2=O)C(=O)Nc2nccs2)cc1
InChIKey
GESAFELMZAUSAB-UHFFFAOYSA-N
Molecular formula
C18H20N2O4S2
Average molar mass
392.5 g/mol

Names & identifiers

Preferred name
2-(4-methanesulfonyl-phenyl)-3-(2-oxo-cyclopentyl)-N-thiazol-2-yl-propionamide
IUPAC
2-(4-methylsulfonylphenyl)-3-(2-oxocyclopentyl)-N-(1,3-thiazol-2-yl)propanamide

Names & synonyms

SCHEMBL2642253GESAFELMZAUSAB-UHFFFAOYSA-N2-(4-methanesulfonyl-phenyl)-3-(2-oxo-cyclopentyl)-N-thiazol-2-yl-propionamide

Database identifiers

PubChem CID
10340494

Properties

Computed structural properties

XLogP
1.9
Topological polar surface area
130 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
6
Heavy atoms
26
Formal charge
0
Complexity
624

Related reactions

3 records
New reaction record
HRID 854783 reaction equation
HRID 854783As productuspto-grants-2007_08
HRID 937517 reaction equation
HRID 937517As productValidation data from https://doi.org/10.1039/C8SC04228D
HRID 2214072 reaction equation
HRID 2214072As productuspto-grants-2006_09

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes