Chemical Component Summary

Name3-({(3R)-1-[(5-bromothiophen-2-yl)carbonyl]pyrrolidin-3-yl}oxy)-N-methyl-2'-[(methylsulfonyl)amino]biphenyl-4-carboxamide
Identifiers2-[(3R)-1-(5-bromanylthiophen-2-yl)carbonylpyrrolidin-3-yl]oxy-N-methyl-4-[2-(methylsulfonylamino)phenyl]benzamide
FormulaC24 H24 Br N3 O5 S2
Molecular Weight578.498
TypeNON-POLYMER
Isomeric SMILESCNC(=O)c1ccc(cc1O[C@@H]2CCN(C2)C(=O)c3ccc(s3)Br)c4ccccc4NS(=O)(=O)C
InChIInChI=1S/C24H24BrN3O5S2/c1-26-23(29)18-8-7-15(17-5-3-4-6-19(17)27-35(2,31)32)13-20(18)33-16-11-12-28(14-16)24(30)21-9-10-22(25)34-21/h3-10,13,16,27H,11-12,14H2,1-2H3,(H,26,29)/t16-/m1/s1
InChIKeyYDBFEELXWGATBW-MRXNPFEDSA-N

Chemical Details

Formal Charge0
Atom Count59
Chiral Atom Count1
Bond Count62
Aromatic Bond Count17

Related Resource References

Resource NameReference
PubChem 91826695
ChEMBL CHEMBL3623144