5-(Acetylamino)-2-sulfanylbenzamide
Basic information
- CAS
173590-78-8- Standard SMILES
CC(=O)Nc1ccc(S)c(C(N)=O)c1- InChIKey
HDIGYNUWISHZRS-UHFFFAOYSA-N- Molecular formula
- C9H10N2O2S
- Average molar mass
- 210.26 g/mol
- Monoisotopic mass
- 210.04629874
Names & identifiers
- Preferred name
- 5-(Acetylamino)-2-sulfanylbenzamide
- IUPAC
- 5-acetamido-2-sulfanylbenzamide
Names & synonyms
5-(Acetylamino)-2-sulfanylbenzamideSCHEMBL88032445-Acetamido-2-mercaptobenzamide5-acetamido-2-sulfanyl-benzamideDTXSID501032075173590-78-8
Database identifiers
- CAS
173590-78-8- PubChem CID
- 468893
- DTXSID
DTXSID501032075
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 73.2 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 245
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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