B8Y

N-{[2-chloro-5-(4-{3-[4-(6-chloro-3-methyl-2-oxo-2,3-dihydro-1H-benzimidazol-1-yl)piperidin-1-yl]propyl}-3-oxo-3,4-dihydropyrazin-2-yl)phenyl]methyl}-4-fluorobenzamide


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Chemical Component Summary

NameN-{[2-chloro-5-(4-{3-[4-(6-chloro-3-methyl-2-oxo-2,3-dihydro-1H-benzimidazol-1-yl)piperidin-1-yl]propyl}-3-oxo-3,4-dihydropyrazin-2-yl)phenyl]methyl}-4-fluorobenzamide
Identifiers~{N}-[[2-chloranyl-5-[4-[3-[4-(6-chloranyl-3-methyl-2-oxidanylidene-benzimidazol-1-yl)piperidin-1-yl]propyl]-3-oxidanylidene-pyrazin-2-yl]phenyl]methyl]-4-fluoranyl-benzamide
FormulaC34 H33 Cl2 F N6 O3
Molecular Weight663.569
TypeNON-POLYMER
Isomeric SMILESCN1c2ccc(cc2N(C1=O)C3CCN(CC3)CCCN4C=CN=C(C4=O)c5ccc(c(c5)CNC(=O)c6ccc(cc6)F)Cl)Cl
InChIInChI=1S/C34H33Cl2FN6O3/c1-40-29-10-6-25(35)20-30(29)43(34(40)46)27-11-16-41(17-12-27)14-2-15-42-18-13-38-31(33(42)45)23-5-9-28(36)24(19-23)21-39-32(44)22-3-7-26(37)8-4-22/h3-10,13,18-20,27H,2,11-12,14-17,21H2,1H3,(H,39,44)
InChIKeyMNEPYBOQUOAGHK-UHFFFAOYSA-N

Chemical Details

Formal Charge0
Atom Count79
Chiral Atom Count0
Bond Count84
Aromatic Bond Count18

Related Resource References

Resource NameReference
Pharos CHEMBL1171505
PubChem 49797978
ChEMBL CHEMBL1171505