2-[[5-[(E)-3-phenylprop-2-enyl]sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]methylsulfanyl]-1,3-benzothiazole
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![2-[[5-[(E)-3-phenylprop-2-enyl]sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]methylsulfanyl]-1,3-benzothiazole structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/22936c526d404efa92f2f07a63b20f9c.png "2-[[5-[(E)-3-phenylprop-2-enyl]sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]methylsulfanyl]-1,3-benzothiazole")
2-[[5-[(E)-3-phenylprop-2-enyl]sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]methylsulfanyl]-1,3-benzothiazole
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CAS No:
315695-44-4
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Formula:
C22H20N4S3
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Chemical Name:
2-[[5-[(E)-3-phenylprop-2-enyl]sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]methylsulfanyl]-1,3-benzothiazole
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Synonyms:
315695-44-4;(E)-2-(((4-allyl-5-(cinnamylthio)-4H-1,2,4-triazol-3-yl)methyl)thio)benzo[d]thiazole;2-{[(5-{[(2E)-3-phenylprop-2-en-1-yl]sulfanyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl)methyl]sulfanyl}-1,3-benzothiazole;2-({[5-{[(2E)-3-phenylprop-2-en-1-yl]sulfanyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]methyl}sulfanyl)-1,3-benzothiazole;ZINC1895701;STK971305;AKOS001046186;2-[[5-[(E)-3-phenylprop-2-enyl]sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]methylsulfanyl]-1,3-benzothiazole;ST50032342;F0876-0029;2-{[5-((2E)-3-phenylprop-2-enylthio)-4-prop-2-enyl-1,2,4-triazol-3-yl]methylth io}benzothiazole
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CAS No:
2-[[5-[(E)-3-phenylprop-2-enyl]sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]methylsulfanyl]-1,3-benzothiazole Basic Attributes
436.6 g/mol
436.08501018 g/mol
Computed Properties
Molecular Weight:436.6
XLogP3:6
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:9
Exact Mass:436.08501018
Monoisotopic Mass:436.08501018
Topological Polar Surface Area:122
Heavy Atom Count:29
Complexity:540
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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