1-[4-(3,5-Dimethylpyrazol-1-yl)phenyl]sulfonyl-5-methyl-3-propyl-2-sulfanylideneimidazolidin-4-one
Basic information
- CAS
79222-86-9- Standard SMILES
CCCN1C(=O)C(C)N(S(=O)(=O)c2ccc(-n3nc(C)cc3C)cc2)C1=S- InChIKey
XVRHTPVFQKTSDF-UHFFFAOYSA-N- Molecular formula
- C18H22N4O3S2
- Average molar mass
- 406.5 g/mol
- Monoisotopic mass
- 406.11333292
Names & identifiers
- Preferred name
- 1-[4-(3,5-Dimethylpyrazol-1-yl)phenyl]sulfonyl-5-methyl-3-propyl-2-sulfanylideneimidazolidin-4-one
- IUPAC
- 1-[4-(3,5-dimethylpyrazol-1-yl)phenyl]sulfonyl-5-methyl-3-propyl-2-sulfanylideneimidazolidin-4-one
Names & synonyms
79222-86-9NSC3360261-[4-(3,5-dimethylpyrazol-1-yl)phenyl]sulfonyl-5-methyl-3-propyl-2-sulfanylideneimidazolidin-4-oneDTXSID20318790NSC-336026DS-0151821-[4-(3,5-Dimethyl-1H-pyrazol-1-yl)benzene-1-sulfonyl]-5-methyl-3-propyl-2-sulfanylideneimidazolidin-4-one4-IMIDAZOLIDINONE,1-[[4-(3,5-DIMETHYL-1H-PYRAZOL-1-YL)PHENYL]SULFONYL]-5-METHYL-3-PROPYL-2-THIOXO-
Database identifiers
- CAS
79222-86-9- PubChem CID
- 333606
- DTXSID
DTXSID20318790
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 116 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 685
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…