3-[[(5Z)-5-[(3-chloro-5-methoxy-4-prop-2-ynoxyphenyl)methylidene]-3-ethyl-4-oxo-1,3-thiazolidin-2-ylidene]amino]benzoic acid
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![3-[[(5Z)-5-[(3-chloro-5-methoxy-4-prop-2-ynoxyphenyl)methylidene]-3-ethyl-4-oxo-1,3-thiazolidin-2-ylidene]amino]benzoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/aa1be8b354c34cbca7e79aefb0555aea.png "3-[[(5Z)-5-[(3-chloro-5-methoxy-4-prop-2-ynoxyphenyl)methylidene]-3-ethyl-4-oxo-1,3-thiazolidin-2-ylidene]amino]benzoic acid")
3-[[(5Z)-5-[(3-chloro-5-methoxy-4-prop-2-ynoxyphenyl)methylidene]-3-ethyl-4-oxo-1,3-thiazolidin-2-ylidene]amino]benzoic acid
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CAS No:
690991-03-8
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Formula:
C23H19ClN2O5S
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Chemical Name:
3-[[(5Z)-5-[(3-chloro-5-methoxy-4-prop-2-ynoxyphenyl)methylidene]-3-ethyl-4-oxo-1,3-thiazolidin-2-ylidene]amino]benzoic acid
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Synonyms:
AKOS000285394;ZINC100310487;3-((E)-((Z)-5-(3-chloro-5-methoxy-4-(prop-2-yn-1-yloxy)benzylidene)-3-ethyl-4-oxothiazolidin-2-ylidene)amino)benzoic acid;3-({5-[3-chloro-5-methoxy-4-(2-propyn-1-yloxy)benzylidene]-3-ethyl-4-oxo-1,3-thiazolidin-2-ylidene}amino)benzoic acid;690991-03-8
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CAS No:
3-[[(5Z)-5-[(3-chloro-5-methoxy-4-prop-2-ynoxyphenyl)methylidene]-3-ethyl-4-oxo-1,3-thiazolidin-2-ylidene]amino]benzoic acid Basic Attributes
470.9 g/mol
470.0703206 g/mol
Computed Properties
Molecular Weight:470.9
XLogP3:4.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:7
Exact Mass:470.0703206
Monoisotopic Mass:470.0703206
Topological Polar Surface Area:114
Heavy Atom Count:32
Complexity:822
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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