2-[3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-1,3-thiazol-3-ium-5-yl]ethyl 4-azido-2-nitrobenzoate;bromide;hydrobromide
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![2-[3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-1,3-thiazol-3-ium-5-yl]ethyl 4-azido-2-nitrobenzoate;bromide;hydrobromide structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/2dc843405c2e41219b7446263d9e8b64.png "2-[3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-1,3-thiazol-3-ium-5-yl]ethyl 4-azido-2-nitrobenzoate;bromide;hydrobromide")
2-[3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-1,3-thiazol-3-ium-5-yl]ethyl 4-azido-2-nitrobenzoate;bromide;hydrobromide
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CAS No:
78897-57-1
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Formula:
C19H20Br2N8O4S
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Chemical Name:
2-[3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-1,3-thiazol-3-ium-5-yl]ethyl 4-azido-2-nitrobenzoate;bromide;hydrobromide
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Synonyms:
4-ANBT;4-azido-2-nitrobenzoylthiamine;78897-57-1;4-Anbt;DTXSID601000124;5-{2-[(4-Azido-2-nitrobenzoyl)oxy]ethyl}-3-[(6-imino-2-methyl-1,6-dihydropyrimidin-5-yl)methyl]-4-methyl-1,3-thiazol-3-ium bromide--hydrogen bromide (1/1/1);Thiazolium, 3-((4-amino-2-methyl-5-pyrimidinyl)methyl)-5-(2-((4-azido-2-nitrobenzoyl)oxy)ethyl)-4-methyl-, bromide, monohydrobromide
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CAS No:
2-[3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-1,3-thiazol-3-ium-5-yl]ethyl 4-azido-2-nitrobenzoate;bromide;hydrobromide Basic Attributes
616.3 g/mol
615.96745 g/mol
Computed Properties
Molecular Weight:616.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:11
Rotatable Bond Count:8
Exact Mass:615.96745
Monoisotopic Mass:613.96950
Topological Polar Surface Area:170
Heavy Atom Count:34
Complexity:718
Covalently-Bonded Unit Count:3
Compound Is Canonicalized:Yes
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2-[3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-1,3-thiazol-3-ium-5-yl]ethyl dihydrogen phosphate;(2R,3R,4S,5R)-2-amino-3,4,5,6-tetrahydroxyhexanal;chloride Formula
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