2-[[5-(4-bromophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-1-(2,5-dimethyl-1-prop-2-enylpyrrol-3-yl)ethanone
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![2-[[5-(4-bromophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-1-(2,5-dimethyl-1-prop-2-enylpyrrol-3-yl)ethanone structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/4dd4dc32f026421da51f9fd32d891b73.png "2-[[5-(4-bromophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-1-(2,5-dimethyl-1-prop-2-enylpyrrol-3-yl)ethanone")
2-[[5-(4-bromophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-1-(2,5-dimethyl-1-prop-2-enylpyrrol-3-yl)ethanone
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CAS No:
763094-79-7
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Formula:
C19H19BrN4OS
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Chemical Name:
2-[[5-(4-bromophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-1-(2,5-dimethyl-1-prop-2-enylpyrrol-3-yl)ethanone
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Synonyms:
ZINC2625510;AKOS033942302;MCULE-3533869660;AB00726119-01;Z25465186;2-{[5-(4-bromophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-[2,5-dimethyl-1-(prop-2-en-1-yl)-1H-pyrrol-3-yl]ethan-1-one;763094-79-7
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CAS No:
2-[[5-(4-bromophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-1-(2,5-dimethyl-1-prop-2-enylpyrrol-3-yl)ethanone Basic Attributes
431.4 g/mol
430.04629 g/mol
Computed Properties
Molecular Weight:431.4
XLogP3:4.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:7
Exact Mass:430.04629
Monoisotopic Mass:430.04629
Topological Polar Surface Area:88.9
Heavy Atom Count:26
Complexity:500
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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