(3E)-3-[[4-(dimethylamino)phenyl]methylidene]-4-imino-8-methylsulfonylpyrimido[2,1-b][1,3]benzothiazol-2-one
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![(3E)-3-[[4-(dimethylamino)phenyl]methylidene]-4-imino-8-methylsulfonylpyrimido[2,1-b][1,3]benzothiazol-2-one structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/5055d739101d4f4c993bc5ce31ad06a1.png "(3E)-3-[[4-(dimethylamino)phenyl]methylidene]-4-imino-8-methylsulfonylpyrimido[2,1-b][1,3]benzothiazol-2-one")
(3E)-3-[[4-(dimethylamino)phenyl]methylidene]-4-imino-8-methylsulfonylpyrimido[2,1-b][1,3]benzothiazol-2-one
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CAS No:
900285-98-5
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Formula:
C20H18N4O3S2
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Chemical Name:
(3E)-3-[[4-(dimethylamino)phenyl]methylidene]-4-imino-8-methylsulfonylpyrimido[2,1-b][1,3]benzothiazol-2-one
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Synonyms:
MLS000776046;CHEMBL1540360;HMS2811M07;ZINC6110607;STK578260;AKOS005502475;SMR000439960;(3E)-3-[4-(dimethylamino)benzylidene]-4-imino-8-(methylsulfonyl)-3,4-dihydro-2H-pyrimido[2,1-b][1,3]benzothiazol-2-one;(E)-3-(4-(dimethylamino)benzylidene)-4-imino-8-(methylsulfonyl)-3,4-dihydro-2H-benzo[4,5]thiazolo[3,2-a]pyrimidin-2-one;3-[1-(4-Dimethylamino-phenyl)-meth-(E)-ylidene]-4-imino-7-methanesulfonyl-3,4-dihydro-9-thia-1,4a-di aza-fluoren-2-one;900285-98-5
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CAS No:
(3E)-3-[[4-(dimethylamino)phenyl]methylidene]-4-imino-8-methylsulfonylpyrimido[2,1-b][1,3]benzothiazol-2-one Basic Attributes
426.5 g/mol
426.08203280 g/mol
Computed Properties
Molecular Weight:426.5
XLogP3:3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:3
Exact Mass:426.08203280
Monoisotopic Mass:426.08203280
Topological Polar Surface Area:128
Heavy Atom Count:29
Complexity:867
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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