2-Chloro-5-((2-(nitromethylene)-1-imidazolidinyl)methyl)thiazole

HCID 184597
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Basic information

CAS
105828-97-5
Standard SMILES
O=[N+]([O-])C=C1NCCN1Cc1cnc(Cl)s1
InChIKey
XKVCBURYVNLQRB-UHFFFAOYSA-N
Molecular formula
C8H9ClN4O2S
Average molar mass
260.7 g/mol
Monoisotopic mass
260.0134744

Names & identifiers

Preferred name
2-Chloro-5-((2-(nitromethylene)-1-imidazolidinyl)methyl)thiazole
IUPAC
2-chloro-5-[[2-(nitromethylidene)imidazolidin-1-yl]methyl]-1,3-thiazole

Names & synonyms

105828-97-52-Chloro-5-[[2-(nitromethylene)-1-imidazolidinyl]methyl]thiazole2-Chloro-5-((2-(nitromethylene)-1-imidazolidinyl)methyl)thiazoleRefChem:258859SCHEMBL888494XKVCBURYVNLQRB-UHFFFAOYSA-NDTXSID7011716451-((2-chlorothiazol-5-yl)methyl)-2-(nitromethylene)imidazolidine2-chloro-5-{[2-(nitromethylidene)imidazolidin-1-yl]methyl}-1,3-thiazole

Database identifiers

CAS
105828-97-5
PubChem CID
184597
DTXSID
DTXSID701171645

Properties

Computed structural properties

XLogP
1.9
Topological polar surface area
102 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
2
Heavy atoms
16

Related reactions

2 records
New reaction record

Compound notes

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