3-ethyl-2-[5-(3-ethyl-6-methoxy-1,3-benzothiazol-3-ium-2-yl)penta-2,4-dienylidene]-6-methoxy-1,3-benzothiazole;iodide
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3-ethyl-2-[5-(3-ethyl-6-methoxy-1,3-benzothiazol-3-ium-2-yl)penta-2,4-dienylidene]-6-methoxy-1,3-benzothiazole;iodide
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CAS No:
14795-76-7
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Formula:
C25H27IN2O2S2
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Chemical Name:
3-ethyl-2-[5-(3-ethyl-6-methoxy-1,3-benzothiazol-3-ium-2-yl)penta-2,4-dienylidene]-6-methoxy-1,3-benzothiazole;iodide
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Synonyms:
DTXSID10933259;14795-76-7;3-Ethyl-2-[5-(3-ethyl-6-methoxy-1,3-benzothiazol-2(3H)-ylidene)penta-1,3-dien-1-yl]-6-methoxy-1,3-benzothiazol-3-ium iodide
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CAS No:
3-ethyl-2-[5-(3-ethyl-6-methoxy-1,3-benzothiazol-3-ium-2-yl)penta-2,4-dienylidene]-6-methoxy-1,3-benzothiazole;iodide Basic Attributes
578.5 g/mol
578.05587 g/mol
Computed Properties
Molecular Weight:578.5
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:7
Exact Mass:578.05587
Monoisotopic Mass:578.05587
Topological Polar Surface Area:79.1
Heavy Atom Count:32
Complexity:628
Undefined Bond Stereocenter Count:3
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
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