2-hydroxy-4-[3-[(5Z)-4-oxo-2-sulfanylidene-5-(thiophen-2-ylmethylidene)-1,3-thiazolidin-3-yl]propanoylamino]benzoic acid
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![2-hydroxy-4-[3-[(5Z)-4-oxo-2-sulfanylidene-5-(thiophen-2-ylmethylidene)-1,3-thiazolidin-3-yl]propanoylamino]benzoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/2910a621f43a44cea519ef9225fb7a7c.png "2-hydroxy-4-[3-[(5Z)-4-oxo-2-sulfanylidene-5-(thiophen-2-ylmethylidene)-1,3-thiazolidin-3-yl]propanoylamino]benzoic acid")
2-hydroxy-4-[3-[(5Z)-4-oxo-2-sulfanylidene-5-(thiophen-2-ylmethylidene)-1,3-thiazolidin-3-yl]propanoylamino]benzoic acid
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CAS No:
356571-85-2
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Formula:
C18H14N2O5S3
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Chemical Name:
2-hydroxy-4-[3-[(5Z)-4-oxo-2-sulfanylidene-5-(thiophen-2-ylmethylidene)-1,3-thiazolidin-3-yl]propanoylamino]benzoic acid
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Synonyms:
MLS001157844;CHEMBL1390923;SCHEMBL12008921;HMS2957G11;ZINC2454540;STK591617;AKOS005513952;SMR000651271;2-hydroxy-4-({3-[(5Z)-4-oxo-5-(thiophen-2-ylmethylidene)-2-thioxo-1,3-thiazolidin-3-yl]propanoyl}amino)benzoic acid;356571-85-2
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CAS No:
2-hydroxy-4-[3-[(5Z)-4-oxo-2-sulfanylidene-5-(thiophen-2-ylmethylidene)-1,3-thiazolidin-3-yl]propanoylamino]benzoic acid Basic Attributes
434.5 g/mol
434.00648507 g/mol
Computed Properties
Molecular Weight:434.5
XLogP3:3.2
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:6
Exact Mass:434.00648507
Monoisotopic Mass:434.00648507
Topological Polar Surface Area:193
Heavy Atom Count:28
Complexity:699
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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