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Basic information
- Standard SMILES
CSc1ncc2c(n1)C=CCS2- InChIKey
BJIYSLLHWMWSGX-UHFFFAOYSA-N- Molecular formula
- C8H8N2S2
- Average molar mass
- 196.3 g/mol
Names & identifiers
- Preferred name
- 2-Methylthio-thiopyranopyrimidine
- IUPAC
- 2-methylsulfanyl-6H-thiopyrano[3,2-d]pyrimidine
Names & synonyms
2-methylthio-thiopyranopyrimidineSCHEMBL11104959BJIYSLLHWMWSGX-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 70513629
Properties
Computed structural propertiesFilling in
- XLogP
- 2
- Topological polar surface area
- 76.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 184
Related reactions
1 records
Compound notes
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