Basic information
- CAS
74277-03-5- Standard SMILES
CC[NH+](CC)CCSc1nc(C)c(CCCl)s1.[Cl-]- InChIKey
ZZRLGDLIAKWSRN-UHFFFAOYSA-N- Molecular formula
- C12H22Cl2N2S2
- Average molar mass
- 329.4 g/mol
- Monoisotopic mass
- 328.0601464
Names & identifiers
- Preferred name
- Ethanamine, 2-((5-(2-chloroethyl)-4-methyl-2-thiazolyl)thio)-N,N-diethyl-, monohydrochloride
- IUPAC
- 2-[[5-(2-chloroethyl)-4-methyl-1,3-thiazol-2-yl]sulfanyl]ethyl-diethylazanium chloride
Names & synonyms
74277-03-52-((5-(2-Chloroethyl)-4-methyl-2-thiazolyl)thio)-N,N-diethylethanamine hydrochlorideEthanamine, 2-((5-(2-chloroethyl)-4-methyl-2-thiazolyl)thio)-N,N-diethyl-, monohydrochlorideRefChem:339811
Database identifiers
- CAS
74277-03-5- PubChem CID
- 53013
Properties
Computed structural properties
- Topological polar surface area
- 70.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 203
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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