4-[2-[[6-hydroxy-1-(4-methylphenyl)-4-oxo-2-sulfanylidenepyrimidin-5-yl]methylideneamino]ethyl]-N-methylpiperazine-1-carbothioamide
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![4-[2-[[6-hydroxy-1-(4-methylphenyl)-4-oxo-2-sulfanylidenepyrimidin-5-yl]methylideneamino]ethyl]-N-methylpiperazine-1-carbothioamide structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/ee5bf553d1424a42b1f47514e60185cc.png "4-[2-[[6-hydroxy-1-(4-methylphenyl)-4-oxo-2-sulfanylidenepyrimidin-5-yl]methylideneamino]ethyl]-N-methylpiperazine-1-carbothioamide")
4-[2-[[6-hydroxy-1-(4-methylphenyl)-4-oxo-2-sulfanylidenepyrimidin-5-yl]methylideneamino]ethyl]-N-methylpiperazine-1-carbothioamide
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CAS No:
672919-48-1
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Formula:
C20H26N6O2S2
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Chemical Name:
4-[2-[[6-hydroxy-1-(4-methylphenyl)-4-oxo-2-sulfanylidenepyrimidin-5-yl]methylideneamino]ethyl]-N-methylpiperazine-1-carbothioamide
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Synonyms:
MLS001213478;CHEMBL2133335;C20H26N6O2S2;HMS2881E24;STL149131;ZINC20436329;AKOS005748855;AKOS032389160;MCULE-6653651369;SMR000540563;672919-48-1;N-methyl-4-[2-({(E)-[1-(4-methylphenyl)-4,6-dioxo-2-sulfanyl-1,6-dihydropyrimidin-5(4H)-ylidene]methyl}amino)ethyl]piperazine-1-carbothioamide
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CAS No:
4-[2-[[6-hydroxy-1-(4-methylphenyl)-4-oxo-2-sulfanylidenepyrimidin-5-yl]methylideneamino]ethyl]-N-methylpiperazine-1-carbothioamide Basic Attributes
446.6 g/mol
446.15586644 g/mol
Computed Properties
Molecular Weight:446.6
XLogP3:1.1
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:446.15586644
Monoisotopic Mass:446.15586644
Topological Polar Surface Area:148
Heavy Atom Count:30
Complexity:725
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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