EWZ

5-{[(4-tert-butyl-6-oxo-1,6-dihydropyrimidin-2-yl)sulfanyl]acetyl}-2-chlorobenzenesulfonamide


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Chemical Component Summary

Name5-{[(4-tert-butyl-6-oxo-1,6-dihydropyrimidin-2-yl)sulfanyl]acetyl}-2-chlorobenzenesulfonamide
Identifiers5-[2-[(4-tert-butyl-6-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]ethanoyl]-2-chloranyl-benzenesulfonamide
FormulaC16 H18 Cl N3 O4 S2
Molecular Weight415.915
TypeNON-POLYMER
Isomeric SMILESCC(C)(C)C1=CC(=O)NC(=N1)SCC(=O)c2ccc(c(c2)S(=O)(=O)N)Cl
InChIInChI=1S/C16H18ClN3O4S2/c1-16(2,3)13-7-14(22)20-15(19-13)25-8-11(21)9-4-5-10(17)12(6-9)26(18,23)24/h4-7H,8H2,1-3H3,(H2,18,23,24)(H,19,20,22)
InChIKeyRKXYDIJRXKLZIZ-UHFFFAOYSA-N

Chemical Details

Formal Charge0
Atom Count44
Chiral Atom Count0
Bond Count45
Aromatic Bond Count6

Related Resource References

Resource NameReference
Pharos CHEMBL2010993
PubChem 59052863, 135566940
ChEMBL CHEMBL2010993