2-[1-(4-Aminophenyl)ethylidene]hydrazinecarbothioamide
Basic information
- CAS
7410-53-9- Standard SMILES
CC(=NNC(N)=S)c1ccc(N)cc1- InChIKey
IKXKPKRBUBTOBD-UHFFFAOYSA-N- Molecular formula
- C9H12N4S
- Average molar mass
- 208.29 g/mol
- Monoisotopic mass
- 208.07826757
Names & identifiers
- Preferred name
- 2-[1-(4-Aminophenyl)ethylidene]hydrazinecarbothioamide
- IUPAC
- [1-(4-aminophenyl)ethylideneamino]thiourea
Names & synonyms
7410-53-92-(1-(4-Aminophenyl)ethylidene)hydrazinecarbothioamide2-[1-(4-Aminophenyl)ethylidene]hydrazinecarbothioamideRefChem:249678DTXSID60350538Hydrazinecarbothioamide, 2-[1-(4-aminophenyl)ethylidene]-p-aminoacetophenone thiosemicarbazone2-[1-(4-Aminophenyl)ethylidene]hydrazine-1-carbothioamide
Database identifiers
- CAS
7410-53-9- PubChem CID
- 682123
- DTXSID
DTXSID60350538
Properties
Computed structural properties
- XLogP
- 0.7
- Topological polar surface area
- 109 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 231
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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