Benzothiazolium, 3-ethyl-5,6-dimethyl-2-[2-[[5-methyl-3-(2-methyl-3-sulfopropyl)-2(3H)-benzoselenazolylidene]methyl]-1-butenyl]-, inner salt
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![Benzothiazolium, 3-ethyl-5,6-dimethyl-2-[2-[[5-methyl-3-(2-methyl-3-sulfopropyl)-2(3H)-benzoselenazolylidene]methyl]-1-butenyl]-, inner salt structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/43db0ee79dd245878028d28e4a02d78f.png "Benzothiazolium, 3-ethyl-5,6-dimethyl-2-[2-[[5-methyl-3-(2-methyl-3-sulfopropyl)-2(3H)-benzoselenazolylidene]methyl]-1-butenyl]-, inner salt")
Benzothiazolium, 3-ethyl-5,6-dimethyl-2-[2-[[5-methyl-3-(2-methyl-3-sulfopropyl)-2(3H)-benzoselenazolylidene]methyl]-1-butenyl]-, inner salt
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CAS No:
94158-30-2
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Formula:
C28H34N2O3S2Se
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Chemical Name:
Benzothiazolium, 3-ethyl-5,6-dimethyl-2-[2-[[5-methyl-3-(2-methyl-3-sulfopropyl)-2(3H)-benzoselenazolylidene]methyl]-1-butenyl]-, inner salt
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Synonyms:
Benzothiazolium,3-ethyl-5,6-dimethyl-2-[2-[[5-methyl-3-(2-methyl-3-sulfopropyl)-2(3H)-benzoselenazolylidene]methyl]-1-butenyl]-,inner salt;Benzothiazolium,3-ethyl-5,6-dimethyl-2-[2-[[5-methyl-3-(2-methyl-3-sulfopropyl)-2(3H)-benzoselenazolylidene]methyl]-1-butenyl]-,hydroxide,inner salt;Benzoselenazole,benzothiazolium deriv.
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CAS No:
Benzothiazolium, 3-ethyl-5,6-dimethyl-2-[2-[[5-methyl-3-(2-methyl-3-sulfopropyl)-2(3H)-benzoselenazolylidene]methyl]-1-butenyl]-, inner salt Basic Attributes
589.67116
590.11761
303-101-0
Computed Properties
Molecular Weight:589.7
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:7
Exact Mass:590.11761
Monoisotopic Mass:590.11761
Topological Polar Surface Area:98
Heavy Atom Count:36
Complexity:920
Undefined Atom Stereocenter Count:1
Defined Bond Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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