Basic information
- Standard SMILES
CC(C)(C)OC(=O)CO/N=C(\C(=O)OS(C)(=O)=O)c1csc(N)n1- InChIKey
SKNYOUHIYOGTQI-DHDCSXOGSA-N- Molecular formula
- C12H17N3O7S2
- Average molar mass
- 379.4 g/mol
Names & identifiers
- Preferred name
- methylsulfonyl (2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethoxy]iminoacetate
- IUPAC
- methylsulfonyl (2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethoxy]iminoacetate
Names & synonyms
SCHEMBL16034200
Database identifiers
- PubChem CID
- 90407632
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 184 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 11
- Rotatable bonds
- 9
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 607
Related reactions
1 records
Compound notes
Loading…