Basic information
- CAS
132411-92-8- Standard SMILES
COc1cccc(N2C(=O)C(=O)N(CCN)C2=S)c1.Cl- InChIKey
WJHCQMPSRIXDNB-UHFFFAOYSA-N- Molecular formula
- C12H14ClN3O3S
- Average molar mass
- 315.78 g/mol
- Monoisotopic mass
- 315.0444402
Names & identifiers
- Preferred name
- 4,5-Imidazolidinedione, 1-(2-aminoethyl)-3-(3-methoxyphenyl)-2-thioxo-, monohydrochloride
- IUPAC
- 1-(2-aminoethyl)-3-(3-methoxyphenyl)-2-sulfanylideneimidazolidine-4,5-dione;hydrochloride
Names & synonyms
4,5-Imidazolidinedione, 1-(2-aminoethyl)-3-(3-methoxyphenyl)-2-thioxo-, monohydrochloride1-(2-Aminoethyl)-3-(3-methoxyphenyl)-2-thioxo-4,5-imidazolidinedione monohydrochloride132411-92-83-(beta-Aminoethylene)-1-m-methoxyphenyl-2-thioxo-4,5-imidazolidinedione hydrochlorideDTXSID70157535RefChem:285584DTXCID60800261-(2-Aminoethyl)-3-(3-methoxyphenyl)-2-sulfanylideneimidazolidine-4,5-dione--hydrogen chloride (1/1)
Database identifiers
- CAS
132411-92-8- PubChem CID
- 3076752
- DTXSID
DTXSID70157535
Properties
Computed structural properties
- Topological polar surface area
- 108 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 402
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…