Basic information
- CAS
592468-12-7- Standard SMILES
COc1ccc(N(CC(=O)NCCSc2ccc(Cl)cc2)S(C)(=O)=O)cc1Cl- InChIKey
BUAVQKDPAYMREQ-UHFFFAOYSA-N- Molecular formula
- C18H20Cl2N2O4S2
- Average molar mass
- 463.4 g/mol
- Monoisotopic mass
- 462.0241549
Names & identifiers
- Preferred name
- 2-(3-chloro-4-methoxy-N-methylsulfonylanilino)-N-[2-(4-chlorophenyl)sulfanylethyl]acetamide
- IUPAC
- 2-(3-chloro-4-methoxy-N-methylsulfonylanilino)-N-[2-(4-chlorophenyl)sulfanylethyl]acetamide
- English name
- 2-[3-chloro-4-methoxy(methylsulfonyl)anilino]-N-{2-[(4-chlorophenyl)sulfanyl]ethyl}acetamide
- Molecular formula
- C18H20Cl2N2O4S2
- Molecular weight
- 463.3984
Names & synonyms
2-(3-chloro-4-methoxy-N-methylsulfonylanilino)-N-[2-(4-chlorophenyl)sulfanylethyl]acetamide2-[3-chloro-4-methoxy(methylsulfonyl)anilino]-N-{2-[(4-chlorophenyl)sulfanyl]ethyl}acetamideSTL086547AKOS000382063AN-989/42063989592468-12-7N~2~-(3-chloro-4-methoxyphenyl)-N-{2-[(4-chlorophenyl)sulfanyl]ethyl}-N~2~-(methylsulfonyl)glycinamide
Database identifiers
- CAS
592468-12-7- PubChem CID
- 1810971
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 109 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 9
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 595
Chemistry & industry
Suppliers1 total
SPECS[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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