Chemical Component Summary

NameN-[6-(6-chloro-5-{[(4-fluorophenyl)sulfonyl]amino}pyridin-3-yl)-1,3-benzothiazol-2-yl]acetamide
IdentifiersN-[6-[6-chloro-5-[(4-fluorophenyl)sulfonylamino]pyridin-3-yl]-1,3-benzothiazol-2-yl]ethanamide
FormulaC20 H14 Cl F N4 O3 S2
Molecular Weight476.932
TypeNON-POLYMER
Isomeric SMILESCC(=O)Nc1nc2ccc(cc2s1)c3cc(c(nc3)Cl)NS(=O)(=O)c4ccc(cc4)F
InChIInChI=1S/C20H14ClFN4O3S2/c1-11(27)24-20-25-16-7-2-12(9-18(16)30-20)13-8-17(19(21)23-10-13)26-31(28,29)15-5-3-14(22)4-6-15/h2-10,26H,1H3,(H,24,25,27)
InChIKeyYGBMCLDVRUGXOV-UHFFFAOYSA-N

Chemical Details

Formal Charge0
Atom Count45
Chiral Atom Count0
Bond Count48
Aromatic Bond Count23

Related Resource References

Resource NameReference
Pharos CHEMBL1615189
PubChem 50990924
ChEMBL CHEMBL1615189