TRaQ-G-ILU

Type : HaloTag-ligand, Benzosilin

Chemical_Nomenclature : [7-azanyl-10-[5-[2-[2-(6-chloranylhexoxy)ethoxy]ethylcarbamoyl]-2-(cyanocarbamoyl)phenyl]-5,5-dimethyl-benzo[b][1]benzosilin-3-ylidene]-methyl-azanium

Canonical SMILES : C[NH+]=C1C=CC2=C(c3ccc(cc3[Si](C2=C1)(C)C)N)c4cc(ccc4C(=O)NC#N)C(=O)NCCOCCOCCCCCCCl

InChI : InChI=1S\/C35H42ClN5O4Si\/c1-39-26-10-13-29-32(22-26)46(2,3)31-21-25(38)9-12-28(31)33(29)30-20-24(8-11-27(30)35(43)41-23-37)34(42)40-15-17-45-19-18-44-16-7-5-4-6-14-36\/h8-13,20-22H,4-7,14-19,38H2,1-3H3,(H,40,42)(H,41,43)\/p+1\/b39-26+

InChIKey : MOOPIZWXYFKFBC-JBFMKSPFSA-O

Other name(s) : ILU

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Families : TRaQ-G-ILU ligand of proteins in family
Haloalkane_dehalogenase-HLD2

Structure :
7ZBD

Protein :
rhoso-halo1