N-(1,3-benzodioxol-5-yl)-2-[[5-[(4-chlorophenoxy)methyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]acetamide
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![N-(1,3-benzodioxol-5-yl)-2-[[5-[(4-chlorophenoxy)methyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]acetamide structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/14b7b67ca7cd4f9ba37fff9115fae6e3.png "N-(1,3-benzodioxol-5-yl)-2-[[5-[(4-chlorophenoxy)methyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]acetamide")
N-(1,3-benzodioxol-5-yl)-2-[[5-[(4-chlorophenoxy)methyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]acetamide
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CAS No:
853582-97-5
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Formula:
C21H19ClN4O4S
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Chemical Name:
N-(1,3-benzodioxol-5-yl)-2-[[5-[(4-chlorophenoxy)methyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]acetamide
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Synonyms:
853582-97-5;ZINC2226075;STK578506;AKOS002295005;MCULE-2952166460;ST50416786;Z24189915;N-(1,3-benzodioxol-5-yl)-2-({5-[(4-chlorophenoxy)methyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide;N-(2H-1,3-benzodioxol-5-yl)-2-({5-[(4-chlorophenoxy)methyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide;N-(2H-benzo[3,4-d]1,3-dioxolen-5-yl)-2-{5-[(4-chlorophenoxy)methyl]-4-prop-2-e nyl(1,2,4-triazol-3-ylthio)}acetamide
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CAS No:
N-(1,3-benzodioxol-5-yl)-2-[[5-[(4-chlorophenoxy)methyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]acetamide Basic Attributes
458.9 g/mol
458.0815540 g/mol
Computed Properties
Molecular Weight:458.9
XLogP3:3.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:9
Exact Mass:458.0815540
Monoisotopic Mass:458.0815540
Topological Polar Surface Area:113
Heavy Atom Count:31
Complexity:610
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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