Ethyl 2-[3-[2-(2-methoxyphenyl)-2-oxoethyl]-4-oxo-2-thiazolidinylidene]acetate

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Basic information

CAS: 848369-53-9
Standard SMILES: CCOC(=O)C=C1SCC(=O)N1CC(=O)c1ccccc1OC
InChIKey: DYECJSHJZJSRTR-UHFFFAOYSA-N
Molecular formula: C16H17NO5S
Average molar mass: 335.4 g/mol
Monoisotopic mass: 335.08274382

Names & identifiers

Preferred name: Ethyl 2-[3-[2-(2-methoxyphenyl)-2-oxoethyl]-4-oxo-2-thiazolidinylidene]acetate
IUPAC: ethyl 2-[3-[2-(2-methoxyphenyl)-2-oxoethyl]-4-oxo-1,3-thiazolidin-2-ylidene]acetate

Names & synonyms

DTXSID001138496AKOS034445878Ethyl 2-[3-[2-(2-methoxyphenyl)-2-oxoethyl]-4-oxo-2-thiazolidinylidene]acetate848369-53-9Ethyl {3-[2-(2-methoxyphenyl)-2-oxoethyl]-4-oxo-1,3-thiazolidin-2-ylidene}acetate

Database identifiers

CAS: 848369-53-9
PubChem CID: 4801993
DTXSID: DTXSID001138496

Properties

Computed structural properties

XLogP: 2
Topological polar surface area: 98.2 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 6
Rotatable bonds: 7
Heavy atoms: 23
Formal charge: 0
Complexity: 505

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Compound notes

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