Basic information
- CAS
174790-48-8- Standard SMILES
CSc1ccc(C=NNC(N)=O)cc1- InChIKey
PVTKETMBAUGQMB-UHFFFAOYSA-N- Molecular formula
- C9H11N3OS
- Average molar mass
- 209.27 g/mol
- Monoisotopic mass
- 209.06228316
Names & identifiers
- Preferred name
- 2-[[4-(Methylthio)phenyl]methylene]hydrazinecarboxamide
- IUPAC
- [(4-methylsulfanylphenyl)methylideneamino]urea
Names & synonyms
2-[[4-(Methylthio)phenyl]methylene]hydrazinecarboxamideDTXSID501203080AKOS017263751174790-48-82-{[4-(Methylsulfanyl)phenyl]methylidene}hydrazine-1-carboxamide
Database identifiers
- CAS
174790-48-8- PubChem CID
- 2588674
- DTXSID
DTXSID501203080
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 92.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 212
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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