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4-[[4-amino-5-(3,4-dimethoxyphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-6-chloro-7-methylchromen-2-one
4-[[4-amino-5-(3,4-dimethoxyphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-6-chloro-7-methylchromen-2-one
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![4-[[4-amino-5-(3,4-dimethoxyphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-6-chloro-7-methylchromen-2-one structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/a286c61ecb68470aadec91044b80cf06.png "4-[[4-amino-5-(3,4-dimethoxyphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-6-chloro-7-methylchromen-2-one")
4-[[4-amino-5-(3,4-dimethoxyphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-6-chloro-7-methylchromen-2-one
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CAS No:
736934-49-9
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Formula:
C21H19ClN4O4S
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Chemical Name:
4-[[4-amino-5-(3,4-dimethoxyphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-6-chloro-7-methylchromen-2-one
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Synonyms:
ZINC3308726;AKOS000882722;MCULE-7777562474;Z25375189;4-({[4-amino-5-(3,4-dimethoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-6-chloro-7-methyl-2H-chromen-2-one;736934-49-9
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CAS No:
4-[[4-amino-5-(3,4-dimethoxyphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-6-chloro-7-methylchromen-2-one Basic Attributes
458.9 g/mol
458.0815540 g/mol
Computed Properties
Molecular Weight:458.9
XLogP3:3.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:6
Exact Mass:458.0815540
Monoisotopic Mass:458.0815540
Topological Polar Surface Area:127
Heavy Atom Count:31
Complexity:686
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Guide of 4-[[4-amino-5-(3,4-dimethoxyphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-6-chloro-7-methylchromen-2-one
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