Basic information
- Standard SMILES
CS(C)=Nc1nccnc1Cl- InChIKey
CGBOBINVUITMEU-UHFFFAOYSA-N- Molecular formula
- C6H8ClN3S
- Average molar mass
- 189.67 g/mol
- Monoisotopic mass
- 189.0127461
Names & identifiers
- Preferred name
- S,S-Dimethyl-N-(3-chloropyrazin-2-yl)sulfilimine
- IUPAC
- (3-chloropyrazin-2-yl)imino-dimethyl-lambda4-sulfane
Names & synonyms
S,S-Dimethyl-N-(3-chloropyrazin-2-yl)sulfilimineSCHEMBL998760CGBOBINVUITMEU-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 548433
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 57.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 158
Related reactions
2 records
Compound notes
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