Basic information
- Standard SMILES
Cc1c(SCc2ccco2)ccnc1CSc1nc2ccccc2[nH]1- InChIKey
SRIRRQVQJOMHOH-UHFFFAOYSA-N- Molecular formula
- C19H17N3OS2
- Average molar mass
- 367.5 g/mol
Names & identifiers
- Preferred name
- 2-{[[4-(2-Furylmethylthio)-3-methyl-2-pyridinyl]methyl]thio}-1H-benzimidazole
- IUPAC
- 2-[[4-(furan-2-ylmethylsulfanyl)-3-methyl-2-pyridinyl]methylsulfanyl]-1H-benzimidazole
Names & synonyms
SCHEMBL8008219SRIRRQVQJOMHOH-UHFFFAOYSA-N2-{[[4-(2-Furylmethylthio)-3-methyl,2-pyridinyl]methyl]thio}-1H-benzimidazole2-{[[4-(2-Furylmethylthio)-3-methyl-2-pyridinyl]methyl]thio}-1H-benzimidazole
Database identifiers
- PubChem CID
- 9799366
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 105 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 427
Related reactions
4 records
Compound notes
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