Basic information
- Standard SMILES
CSc1nn(-c2ccccc2)c2cc(NC(=O)NC3CCNC3)ccc12.Cl- InChIKey
NMTGNCGKCDDWHZ-UHFFFAOYSA-N- Molecular formula
- C19H22ClN5OS
- Average molar mass
- 403.9 g/mol
Names & identifiers
- Preferred name
- 1-(3-(methylthio)-1-phenyl-1H-indazol-6-yl)-3-(pyrrolidin-3-yl)urea hydrochloride
- IUPAC
- 1-(3-methylsulfanyl-1-phenylindazol-6-yl)-3-pyrrolidin-3-ylurea;hydrochloride
Names & synonyms
SCHEMBL2551129NMTGNCGKCDDWHZ-UHFFFAOYSA-N1-(3-(methylthio)-1-phenyl-1H-indazol-6-yl)-3-(pyrrolidin-3-yl)urea hydrochloride
Database identifiers
- PubChem CID
- 67449463
Properties
Computed structural properties
- Topological polar surface area
- 96.3 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 487
Related reactions
1 records
Compound notes
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