4-[[2,5-bis(methylsulfanyl)pyrimidin-4-yl]amino]benzonitrile
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![4-[[2,5-bis(methylsulfanyl)pyrimidin-4-yl]amino]benzonitrile structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/a3420a1f95c44a3282d53e2c2b7c036e.png "4-[[2,5-bis(methylsulfanyl)pyrimidin-4-yl]amino]benzonitrile")
4-[[2,5-bis(methylsulfanyl)pyrimidin-4-yl]amino]benzonitrile
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CAS No:
7402-64-4
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Formula:
C13H12N4S2
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Chemical Name:
4-[[2,5-bis(methylsulfanyl)pyrimidin-4-yl]amino]benzonitrile
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Synonyms:
NSC54665;4-{[2,5-bis(methylsulfanyl)pyrimidin-4-yl]amino}benzonitrile;NCIOpen2_002088;CTK5D9191;DTXSID50288194;ZINC1685270;NSC-54665;Benzonitrile,4-[[2,5-bis(methylthio)-4-pyrimidinyl]amino]-
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CAS No:
4-[[2,5-bis(methylsulfanyl)pyrimidin-4-yl]amino]benzonitrile Basic Attributes
288.387
288.05
54665
DTXSID50288194
Computed Properties
Molecular Weight:288.4
XLogP3:3.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:4
Exact Mass:288.05033875
Monoisotopic Mass:288.05033875
Topological Polar Surface Area:112
Heavy Atom Count:19
Complexity:322
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Guide of 4-[[2,5-bis(methylsulfanyl)pyrimidin-4-yl]amino]benzonitrile
4-[[2,5-bis(methylsulfanyl)pyrimidin-4-yl]amino]benzonitrile
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