2-methyl-N-[(5E)-5-[(6-nitro-1,3-benzodioxol-5-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]benzamide
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![2-methyl-N-[(5E)-5-[(6-nitro-1,3-benzodioxol-5-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]benzamide structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/85c199b446a041ffbe86d19d1f0e78d1.png "2-methyl-N-[(5E)-5-[(6-nitro-1,3-benzodioxol-5-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]benzamide")
2-methyl-N-[(5E)-5-[(6-nitro-1,3-benzodioxol-5-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]benzamide
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CAS No:
301692-14-8
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Formula:
C19H13N3O6S2
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Chemical Name:
2-methyl-N-[(5E)-5-[(6-nitro-1,3-benzodioxol-5-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]benzamide
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Synonyms:
C19H13N3O6S2;ZINC9088294;STK969780;AKOS001599626;ST50186728;(2-methylphenyl)-N-{5-[(6-nitro(2H-benzo[3,4-d]1,3-dioxolen-5-yl))methylene]-4 -oxo-2-thioxo(1,3-thiazolidin-3-yl)}carboxamide;2-methyl-N-{(5E)-5-[(6-nitro-1,3-benzodioxol-5-yl)methylene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}benzamide;2-methyl-N-{(5E)-5-[(6-nitro-1,3-benzodioxol-5-yl)methylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}benzamide;301692-14-8
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CAS No:
2-methyl-N-[(5E)-5-[(6-nitro-1,3-benzodioxol-5-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]benzamide Basic Attributes
443.5 g/mol
443.02457749 g/mol
Computed Properties
Molecular Weight:443.5
XLogP3:4.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:2
Exact Mass:443.02457749
Monoisotopic Mass:443.02457749
Topological Polar Surface Area:171
Heavy Atom Count:30
Complexity:785
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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