DWY

[4-({4-[(5Z)-5-(3,4-dichlorobenzylidene)-4-oxo-4,5-dihydro-1,3-thiazol-2-yl]piperazin-1-yl}methyl)phenyl]boronic acid


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Chemical Component Summary

Name[4-({4-[(5Z)-5-(3,4-dichlorobenzylidene)-4-oxo-4,5-dihydro-1,3-thiazol-2-yl]piperazin-1-yl}methyl)phenyl]boronic acid
Identifiers[4-[[4-[(5Z)-5-[(3,4-dichlorophenyl)methylidene]-4-oxidanylidene-1,3-thiazol-2-yl]piperazin-1-yl]methyl]phenyl]boronic acid
FormulaC21 H20 B Cl2 N3 O3 S
Molecular Weight476.184
TypeNON-POLYMER
Isomeric SMILESB(c1ccc(cc1)CN2CCN(CC2)C3=NC(=O)/C(=C/c4ccc(c(c4)Cl)Cl)/S3)(O)O
InChIInChI=1S/C21H20BCl2N3O3S/c23-17-6-3-15(11-18(17)24)12-19-20(28)25-21(31-19)27-9-7-26(8-10-27)13-14-1-4-16(5-2-14)22(29)30/h1-6,11-12,29-30H,7-10,13H2/b19-12-
InChIKeyCKUAZJLGUCZSNN-UNOMPAQXSA-N

Chemical Details

Formal Charge0
Atom Count51
Chiral Atom Count0
Bond Count54
Aromatic Bond Count12

Related Resource References

Resource NameReference
PubChem 72699323