Basic information
- Standard SMILES
COCCn1c2c(sc1=NC(=O)C1C(C)(C)C1(C)C)CCCC2- InChIKey
CHPVIPIACXCHEG-UHFFFAOYSA-N- Molecular formula
- C18H28N2O2S
- Average molar mass
- 336.5 g/mol
Names & identifiers
- Preferred name
- 2,2,3,3-Tetramethylcyclopropanecarboxylic acid [3-(2-methoxy-ethy)-4,5,6,7-tetrahydro-3H-benzothiazol-2-ylidene]-amide
- IUPAC
- N-[3-(2-methoxyethyl)-4,5,6,7-tetrahydro-1,3-benzothiazol-2-ylidene]-2,2,3,3-tetramethylcyclopropane-1-carboxamide
Names & synonyms
SCHEMBL3387709SCHEMBL3387714CHPVIPIACXCHEG-UHFFFAOYSA-N2,2,3,3-Tetramethylcyclopropanecarboxylic acid [3-(2-methoxy-ethy)-4,5,6,7-tetrahydro-3H-benzothiazol-2-ylidene]-amide
Database identifiers
- PubChem CID
- 68623747
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 67.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 564
Related reactions
1 records
Compound notes
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