N-[5-(1,3-benzothiazol-2-ylsulfanylmethyl)-1H-1,2,4-triazol-3-yl]-4-chlorobenzamide
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![N-[5-(1,3-benzothiazol-2-ylsulfanylmethyl)-1H-1,2,4-triazol-3-yl]-4-chlorobenzamide structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/0d7e71a078584b8d8c9de028f9a8e02d.png "N-[5-(1,3-benzothiazol-2-ylsulfanylmethyl)-1H-1,2,4-triazol-3-yl]-4-chlorobenzamide")
N-[5-(1,3-benzothiazol-2-ylsulfanylmethyl)-1H-1,2,4-triazol-3-yl]-4-chlorobenzamide
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CAS No:
810686-75-0
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Formula:
C17H12ClN5OS2
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Chemical Name:
N-[5-(1,3-benzothiazol-2-ylsulfanylmethyl)-1H-1,2,4-triazol-3-yl]-4-chlorobenzamide
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Synonyms:
ZINC8771632;STK209931;AKOS000613708;MCULE-2920525625;ST50160720;N-[5-(benzothiazol-2-ylthiomethyl)(1H-1,2,4-triazol-3-yl)](4-chlorophenyl)carb oxamide;N-{5-[(1,3-benzothiazol-2-ylsulfanyl)methyl]-1H-1,2,4-triazol-3-yl}-4-chlorobenzamide;810686-75-0
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CAS No:
N-[5-(1,3-benzothiazol-2-ylsulfanylmethyl)-1H-1,2,4-triazol-3-yl]-4-chlorobenzamide Basic Attributes
401.9 g/mol
401.0171801 g/mol
Computed Properties
Molecular Weight:401.9
XLogP3:4.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:401.0171801
Monoisotopic Mass:401.0171801
Topological Polar Surface Area:137
Heavy Atom Count:26
Complexity:494
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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