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4-bromo-2-[5-[(3-nitrophenyl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]phenol
4-bromo-2-[5-[(3-nitrophenyl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]phenol
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![4-bromo-2-[5-[(3-nitrophenyl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]phenol structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/5f1358f290e1472eb854f3fdc5b9caa6.png "4-bromo-2-[5-[(3-nitrophenyl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]phenol")
4-bromo-2-[5-[(3-nitrophenyl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]phenol
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CAS No:
824423-75-8
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Formula:
C18H15BrN4O3S
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Chemical Name:
4-bromo-2-[5-[(3-nitrophenyl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]phenol
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Synonyms:
ZINC2857351;STK805346;AKOS000416333;MCULE-7638131510;4-bromo-2-{5-[(3-nitrobenzyl)sulfanyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}phenol;824423-75-8
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CAS No:
4-bromo-2-[5-[(3-nitrophenyl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]phenol Basic Attributes
447.3 g/mol
446.00482 g/mol
Computed Properties
Molecular Weight:447.3
XLogP3:4.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:446.00482
Monoisotopic Mass:446.00482
Topological Polar Surface Area:122
Heavy Atom Count:27
Complexity:523
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Guide of 4-bromo-2-[5-[(3-nitrophenyl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]phenol
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