CHEBI:135865 - bisoctrizole

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ChEBI Name bisoctrizole
ChEBI ID CHEBI:135865
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C41H50N6O2
Net Charge 0
Average Mass 658.876
Monoisotopic Mass 658.39952
InChI InChI=1S/C41H50N6O2/c1-38(2,3)24-40(7,8)28-20-26(36(48)34(22-28)46-42-30-15-11-12-16-31(30)43-46)19-27-21-29(41(9,10)25-39(4,5)6)23-35(37(27)49)47-44-32-17-13-14-18-33(32)45-47/h11-18,20-23,48-49H,19,24-25H2,1-10H3
InChIKey FQUNFJULCYSSOP-UHFFFAOYSA-N
SMILES OC=1C(N2N=C3C(=N2)C=CC=C3)=CC(=CC1CC4=C(O)C(=CC(=C4)C(CC(C)(C)C)(C)C)N5N=C6C(=N5)C=CC=C6)C(CC(C)(C)C)(C)C
ChEBI Ontology
Outgoing bisoctrizole (CHEBI:135865) is a diarylmethane (CHEBI:51614)
Synonym Source
bisoctyltriazole DrugCentral
Manual Xref Database
3031 DrugCentral
View more database links
Registry Number Type Source
103597-45-1 CAS Registry Number DrugCentral
Last Modified
23 February 2017