AC1Lrg4D
Basic information
- CAS
5534-93-0- Standard SMILES
COc1ccccc1/C=C1\SC(=S)N(NC(=O)c2ccccc2Cl)C1=O- InChIKey
MOWZGRUMZNEARW-GDNBJRDFSA-N- Molecular formula
- C18H13ClN2O3S2
- Average molar mass
- 404.9 g/mol
- Monoisotopic mass
- 404.0056123
Names & identifiers
- Preferred name
- AC1Lrg4D
- IUPAC
- 2-chloro-N-[(5Z)-5-[(2-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]benzamide
Names & synonyms
AC1LRG4DDTXSID803622795534-93-0RefChem:313965DTXCID40313328299952-83-3(Z)-2-chloro-N-(5-(2-methoxybenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)benzamide2-chloro-N-[(5Z)-5-[(2-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]benzamideF0207-08722-chloro-N-[5-(2-methoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]benzamide2-Chloro-N-{(5Z)-5-[(2-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}benzamideSMSSF-0039924
Show more names
CCG-10320STL005731AKOS002199248BIM-0023854.P001ST50147412AF-399/10512048(Z)-3-(o-chlorobenzoylamino)-5-[(o-methoxyphenyl)methylene]-2-thioxo-1,3-thiazolidin-4-one2-chloro-N-[(5Z)-5-(2-methoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]benzamide
Database identifiers
- CAS
5534-93-0- PubChem CID
- 1368367
- DTXSID
DTXSID80362279
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 116 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 613
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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