2-[(5E)-5-[[5-(3-nitrophenyl)furan-2-yl]methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanesulfonic acid
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![2-[(5E)-5-[[5-(3-nitrophenyl)furan-2-yl]methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanesulfonic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/4adcf897e8544993b72c4482e2df84e1.png "2-[(5E)-5-[[5-(3-nitrophenyl)furan-2-yl]methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanesulfonic acid")
2-[(5E)-5-[[5-(3-nitrophenyl)furan-2-yl]methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanesulfonic acid
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CAS No:
373611-94-0
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Formula:
C16H12N2O7S3
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Chemical Name:
2-[(5E)-5-[[5-(3-nitrophenyl)furan-2-yl]methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanesulfonic acid
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Synonyms:
2-[(5E)-5-{[5-(3-nitrophenyl)furan-2-yl]methylidene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]ethanesulfonic acid;SCHEMBL1905953;SCHEMBL1905955;CHEMBL3263100;ZINC1774488;STK701578;AKOS000526059;ST056872;2-((5E)-5-{[5-(3-NITROPHENYL)-2-FURYL]METHYLENE}-4-OXO-2-THIOXO-1,3-THIAZOLIDIN-3-YL)ETHANESULFONIC ACID;2-(5-{[5-(3-nitrophenyl)(2-furyl)]methylene}-4-oxo-2-thioxo-1,3-thiazolidin-3- yl)ethanesulfonic acid;2-[(5E)-5-[[5-(3-nitrophenyl)-2-furyl]methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]ethanesulfonic acid;373611-94-0
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CAS No:
2-[(5E)-5-[[5-(3-nitrophenyl)furan-2-yl]methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanesulfonic acid Basic Attributes
440.5 g/mol
439.98066425 g/mol
Computed Properties
Molecular Weight:440.5
XLogP3:2.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:5
Exact Mass:439.98066425
Monoisotopic Mass:439.98066425
Topological Polar Surface Area:199
Heavy Atom Count:28
Complexity:787
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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