Basic information
- CAS
70618-70-1- Standard SMILES
Br.CCN(CC)CCCC(C)NC(=S)N/N=C(\C)c1ccccn1- InChIKey
GCQUORUMMZFMFS-QMGGKDRNSA-N- Molecular formula
- C17H30BrN5S
- Average molar mass
- 416.4 g/mol
- Monoisotopic mass
- 415.14053
Names & identifiers
- Preferred name
- Hydrazinecarbothioamide, dihydrobromide
- IUPAC
- 1-[5-(diethylamino)pentan-2-yl]-3-[(E)-1-pyridin-2-ylethylideneamino]thiourea;hydrobromide
Names & synonyms
70618-70-1Hydrazinecarbothioamide, dihydrobromideCHEMBL3250567DTXSID50712525NSC296300NSC-296300(2E)-N-[5-(Diethylamino)pentan-2-yl]-2-[1-(pyridin-2-yl)ethylidene]hydrazine-1-carbothioamide--hydrogen bromide (1/1)
Database identifiers
- CAS
70618-70-1- PubChem CID
- 54598640
- DTXSID
DTXSID50712525- ChEMBL
CHEMBL3250567
Properties
Computed structural properties
- Topological polar surface area
- 84.6 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 9
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 368
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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