Basic information
- Standard SMILES
Cc1cnc(CS(=O)c2nc3ccccc3[nH]2)c(C)c1OCC1COC(C)(C)OC1.[Na]- InChIKey
OBTLSOQZVRHZGT-UHFFFAOYSA-N- Molecular formula
- C22H27N3NaO4S
- Average molar mass
- 452.5 g/mol
Names & identifiers
- Preferred name
- 2-(((4-((2,2-Dimethyl-1,3-dioxan-5-yl)methoxy)-3,5-dimethylpyridin-2-yl)methyl)sulfinyl)-1h-benzimidazole sodium salt
Names & synonyms
SCHEMBL711094orb3174166OBTLSOQZVRHZGT-UHFFFAOYSA-N2-(((4-((2,2-dimethyl-1,3-dioxan-5-yl)methoxy)-3,5-dimethylpyridin-2-yl)methyl)sulfinyl)-1h-benzimidazole sodium salt
Database identifiers
- PubChem CID
- 66775847
Properties
Computed structural properties
- Topological polar surface area
- 106 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 6
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 597
Related reactions
2 records
Compound notes
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