Basic information
- Standard SMILES
CSC(=NCC(=O)N1C2CC3CCC2(CS1(=O)=O)C3(C)C)SC- InChIKey
IXTNNTWFDQGMIN-UHFFFAOYSA-N- Molecular formula
- C15H24N2O3S3
- Average molar mass
- 376.6 g/mol
Names & identifiers
- Preferred name
- 2-(Bis-methylsulfanyl-methyleneamino)-1-(10,10-dimethyl-3,3-dioxo-3-thia-4-aza-tricyclo(5.2.1.0 1,5)dec-4-yl)-ethanone
- IUPAC
- 2-[bis(methylsulfanyl)methylideneamino]-1-(10,10-dimethyl-3,3-dioxo-3λ6-thia-4-azatricyclo[5.2.1.01,5]decan-4-yl)ethanone
Names & synonyms
2-(bis-methylsulfanyl-methyleneamino)-1-(10,10-dimethyl-3,3-dioxo-3-thia-4-aza-tricyclo(5.2.1.0 1,5)dec-4-yl)-ethanone2-(bis-methylsulfanyl-methyleneamino)-1-(10,10-dimethyl-3,3-dioxo-3-thia-4-aza-tricyclo[5.2.1.0 1,5]dec-4-yl)-ethanoneSCHEMBL7156071IXTNNTWFDQGMIN-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 14430217
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 126 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 647
Related reactions
4 records
Compound notes
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