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[methylsulfanyl-[1-[3-[4-[methylsulfanyl(oxoazaniumyl)methylidene]pyridin-1-yl]propyl]pyridin-4-ylidene]methyl]-oxoazanium,dibromide
[methylsulfanyl-[1-[3-[4-[methylsulfanyl(oxoazaniumyl)methylidene]pyridin-1-yl]propyl]pyridin-4-ylidene]methyl]-oxoazanium,dibromide
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![[methylsulfanyl-[1-[3-[4-[methylsulfanyl(oxoazaniumyl)methylidene]pyridin-1-yl]propyl]pyridin-4-ylidene]methyl]-oxoazanium,dibromide structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/1d92f90db271443da76e6d17b4aed729.png "[methylsulfanyl-[1-[3-[4-[methylsulfanyl(oxoazaniumyl)methylidene]pyridin-1-yl]propyl]pyridin-4-ylidene]methyl]-oxoazanium,dibromide")
[methylsulfanyl-[1-[3-[4-[methylsulfanyl(oxoazaniumyl)methylidene]pyridin-1-yl]propyl]pyridin-4-ylidene]methyl]-oxoazanium,dibromide
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CAS No:
99761-21-4
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Formula:
C17H22Br2N4O2S2
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Chemical Name:
[methylsulfanyl-[1-[3-[4-[methylsulfanyl(oxoazaniumyl)methylidene]pyridin-1-yl]propyl]pyridin-4-ylidene]methyl]-oxoazanium,dibromide
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Synonyms:
Methylthio tmb-4;
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CAS No:
[methylsulfanyl-[1-[3-[4-[methylsulfanyl(oxoazaniumyl)methylidene]pyridin-1-yl]propyl]pyridin-4-ylidene]methyl]-oxoazanium,dibromide Basic Attributes
538.32000
537.95304
Computed Properties
Molecular Weight:538.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:8
Exact Mass:537.95304
Monoisotopic Mass:535.95509
Topological Polar Surface Area:124
Heavy Atom Count:27
Complexity:406
Defined Bond Stereocenter Count:2
Covalently-Bonded Unit Count:3
Compound Is Canonicalized:Yes
Guide of [methylsulfanyl-[1-[3-[4-[methylsulfanyl(oxoazaniumyl)methylidene]pyridin-1-yl]propyl]pyridin-4-ylidene]methyl]-oxoazanium,dibromide
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