2-[4-[(5E)-5-(furan-2-ylmethylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoylamino]benzoic acid
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![2-[4-[(5E)-5-(furan-2-ylmethylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoylamino]benzoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/d285d8540eb34c5492875196a781f12d.png "2-[4-[(5E)-5-(furan-2-ylmethylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoylamino]benzoic acid")
2-[4-[(5E)-5-(furan-2-ylmethylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoylamino]benzoic acid
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CAS No:
637318-96-8
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Formula:
C19H16N2O5S2
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Chemical Name:
2-[4-[(5E)-5-(furan-2-ylmethylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoylamino]benzoic acid
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Synonyms:
637318-96-8;(E)-2-(4-(5-(furan-2-ylmethylene)-4-oxo-2-thioxothiazolidin-3-yl)butanamido)benzoic acid;2-{4-[(5E)-5-[(furan-2-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanamido}benzoic acid;ZINC8763453;STK711865;AKOS002182105;2-[4-[(5E)-5-(furan-2-ylmethylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoylamino]benzoic acid;ST50069670;SR-01000010186;SR-01000010186-1;F1063-2020;2-({4-[(5E)-5-(furan-2-ylmethylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanoyl}amino)benzoic acid;2-{4-[5-(2-furylmethylene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanoylamino}b enzoic acid
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CAS No:
2-[4-[(5E)-5-(furan-2-ylmethylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoylamino]benzoic acid Basic Attributes
416.5 g/mol
416.05006396 g/mol
Computed Properties
Molecular Weight:416.5
XLogP3:3.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:7
Exact Mass:416.05006396
Monoisotopic Mass:416.05006396
Topological Polar Surface Area:157
Heavy Atom Count:28
Complexity:681
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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