2-benzylsulfanyl-5-[(E)-3-phenylprop-2-enyl]sulfanyl-1,3,4-thiadiazole
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![2-benzylsulfanyl-5-[(E)-3-phenylprop-2-enyl]sulfanyl-1,3,4-thiadiazole structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/894d6b7613ca4f3b99cb133d459ef5c7.png "2-benzylsulfanyl-5-[(E)-3-phenylprop-2-enyl]sulfanyl-1,3,4-thiadiazole")
2-benzylsulfanyl-5-[(E)-3-phenylprop-2-enyl]sulfanyl-1,3,4-thiadiazole
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CAS No:
477735-15-2
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Formula:
C18H16N2S3
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Chemical Name:
2-benzylsulfanyl-5-[(E)-3-phenylprop-2-enyl]sulfanyl-1,3,4-thiadiazole
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Synonyms:
2-(Benzylthio)-5-(cinnamylthio)-1,3,4-thiadiazole;2-((2E)-3-phenylprop-2-enylthio)-5-(phenylmethylthio)-1,3,4-thiadiazole;477735-15-2;C18H16N2S3;ZINC2229191;STL337794;AKOS002178124;ST044670;2-(benzylsulfanyl)-5-{[(2E)-3-phenylprop-2-en-1-yl]sulfanyl}-1,3,4-thiadiazole
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CAS No:
2-benzylsulfanyl-5-[(E)-3-phenylprop-2-enyl]sulfanyl-1,3,4-thiadiazole Basic Attributes
356.5 g/mol
356.04756204 g/mol
Safety Information
|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P273, 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:356.5
XLogP3:5.7
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:7
Exact Mass:356.04756204
Monoisotopic Mass:356.04756204
Topological Polar Surface Area:105
Heavy Atom Count:23
Complexity:352
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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