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3-(4-ethoxyphenyl)-4-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-1H-1,2,4-triazole-5-thione
3-(4-ethoxyphenyl)-4-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-1H-1,2,4-triazole-5-thione
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![3-(4-ethoxyphenyl)-4-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-1H-1,2,4-triazole-5-thione structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/17dff910ffe642eea93c42c8725aa619.png "3-(4-ethoxyphenyl)-4-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-1H-1,2,4-triazole-5-thione")
3-(4-ethoxyphenyl)-4-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-1H-1,2,4-triazole-5-thione
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CAS No:
733031-70-4
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Formula:
C18H15N5O5S
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Chemical Name:
3-(4-ethoxyphenyl)-4-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-1H-1,2,4-triazole-5-thione
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Synonyms:
AKOS034468322;MCULE-2863679701;Z56960393;5-(4-ethoxyphenyl)-4-{[(6-nitro-2H-1,3-benzodioxol-5-yl)methylidene]amino}-4H-1,2,4-triazole-3-thiol;733031-70-4
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CAS No:
3-(4-ethoxyphenyl)-4-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-1H-1,2,4-triazole-5-thione Basic Attributes
413.4 g/mol
413.07938977 g/mol
Computed Properties
Molecular Weight:413.4
XLogP3:3.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:5
Exact Mass:413.07938977
Monoisotopic Mass:413.07938977
Topological Polar Surface Area:146
Heavy Atom Count:29
Complexity:691
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Guide of 3-(4-ethoxyphenyl)-4-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-1H-1,2,4-triazole-5-thione
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