Basic information
- Standard SMILES
O=[N+]([O-])C=C1SCCN1Cc1ccc(Cl)nc1- InChIKey
ZTLMFNYACJYRIS-UHFFFAOYSA-N- Molecular formula
- C10H10ClN3O2S
- Average molar mass
- 271.72 g/mol
- Monoisotopic mass
- 271.01822524
Names & identifiers
- Preferred name
- 2-Chloro-5-[[2-(nitromethylene)-3-thiazolidinyl]methyl]pyridine
- IUPAC
- 3-[(6-chloro-3-pyridinyl)methyl]-2-(nitromethylidene)-1,3-thiazolidine
Names & synonyms
105827-70-12-Chloro-5-[[2-(nitromethylene)-3-thiazolidinyl]methyl]pyridine2-Chloro-5-((2-(nitromethylene)-3-thiazolidinyl)methyl)pyridineRefChem:258860SCHEMBL10200013-(2-chloro-5-pyridylmethyl)-2-nitromethylenethiazolidineZTLMFNYACJYRIS-UHFFFAOYSA-NDTXSID5011734573-(6-chloronicotinyl)-2-nitromethylene-thiazolidine3-(2-chloro-5-pyridylmethyl)-2nitromethylenethiazolidine3-(2-chloro-5 -pyridylmethyl)-2-nitromethylenethiazolidine2-chloro-5-{[2-(nitromethylidene)-1,3-thiazolidin-3-yl]methyl}pyridine
Database identifiers
- CAS
105827-70-1- PubChem CID
- 54565385
- DTXSID
DTXSID501173457
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 87.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 321
Related reactions
12 records
Linked notes
Loading…