Basic information
- Standard SMILES
CCOc1cc(CNC(=S)NC(=O)OCC2c3ccccc3-c3ccccc32)ncc1C(=O)NC- InChIKey
WBTQRUCZQMHVAM-UHFFFAOYSA-N- Molecular formula
- C26H26N4O4S
- Average molar mass
- 490.6 g/mol
Names & identifiers
- Preferred name
- N-(4-Ethoxy-5-methylcarbamoylpyridin-2-ylmethyl)-N'-(fluoren-9-ylmethyloxycarbonyl)thiourea
- IUPAC
- 9H-fluoren-9-ylmethyl N-[[4-ethoxy-5-(methylcarbamoyl)-2-pyridinyl]methylcarbamothioyl]carbamate
Names & synonyms
SCHEMBL2083638WBTQRUCZQMHVAM-UHFFFAOYSA-NN-(4-Ethoxy-5-methylcarbamoylpyridin-2-ylmethyl)-N'-(fluoren-9-ylmethyloxycarbonyl)thioureaN-(4-ethoxy-5-methylcarbamoyl pyridin-2-ylmethyl)-N'-(fluoren-9-ylmethyloxycarbonyl)thiourea
Database identifiers
- PubChem CID
- 57791308
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 134 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 8
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 731
Related reactions
3 records
Linked notes
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