(3E)-4-imino-7,8-dimethyl-3-[(4-oxochromen-3-yl)methylidene]pyrimido[2,1-b][1,3]benzothiazol-2-one
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![(3E)-4-imino-7,8-dimethyl-3-[(4-oxochromen-3-yl)methylidene]pyrimido[2,1-b][1,3]benzothiazol-2-one structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/6f99d54b83df4834ab8b55cde29a7eab.png "(3E)-4-imino-7,8-dimethyl-3-[(4-oxochromen-3-yl)methylidene]pyrimido[2,1-b][1,3]benzothiazol-2-one")
(3E)-4-imino-7,8-dimethyl-3-[(4-oxochromen-3-yl)methylidene]pyrimido[2,1-b][1,3]benzothiazol-2-one
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CAS No:
896817-98-4
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Formula:
C22H15N3O3S
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Chemical Name:
(3E)-4-imino-7,8-dimethyl-3-[(4-oxochromen-3-yl)methylidene]pyrimido[2,1-b][1,3]benzothiazol-2-one
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Synonyms:
MLS000332053;ZINC3859103;STK594256;AKOS005516271;SMR000221478;(3E)-4-imino-7,8-dimethyl-3-[(4-oxo-4H-chromen-3-yl)methylidene]-3,4-dihydro-2H-pyrimido[2,1-b][1,3]benzothiazol-2-one;4-Imino-6,7-dimethyl-3-[1-(4-oxo-4H-chromen-3-yl)-meth-(E)-ylidene]-3,4-dihydro-9-thia-1,4a-diaza-fluoren-2-one;896817-98-4
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CAS No:
(3E)-4-imino-7,8-dimethyl-3-[(4-oxochromen-3-yl)methylidene]pyrimido[2,1-b][1,3]benzothiazol-2-one Basic Attributes
401.4 g/mol
401.08341252 g/mol
Computed Properties
Molecular Weight:401.4
XLogP3:4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:1
Exact Mass:401.08341252
Monoisotopic Mass:401.08341252
Topological Polar Surface Area:108
Heavy Atom Count:29
Complexity:877
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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