N-(4-butylphenyl)-2-[(4-ethyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide
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![N-(4-butylphenyl)-2-[(4-ethyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/9add9e502ee849968785ab8e13ecaea0.png "N-(4-butylphenyl)-2-[(4-ethyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide")
N-(4-butylphenyl)-2-[(4-ethyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide
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CAS No:
618426-72-5
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Formula:
C21H25N5OS
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Chemical Name:
N-(4-butylphenyl)-2-[(4-ethyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide
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Synonyms:
618426-72-5;SCHEMBL15986082;ZINC2448091;SALOR-INT L368741-1EA;STL340040;AKOS002190278;MCULE-5836221927;N-(4-butylphenyl)-2-{[4-ethyl-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide;ST50081072;N-(4-butylphenyl)-2-(4-ethyl-5-(3-pyridyl)(1,2,4-triazol-3-ylthio))acetamide
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CAS No:
N-(4-butylphenyl)-2-[(4-ethyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide Basic Attributes
395.5 g/mol
395.17798161 g/mol
Safety Information
|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:395.5
XLogP3:3.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:9
Exact Mass:395.17798161
Monoisotopic Mass:395.17798161
Topological Polar Surface Area:98
Heavy Atom Count:28
Complexity:472
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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