CHEBI:134716 - brexpiprazole

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ChEBI Name brexpiprazole
ChEBI ID CHEBI:134716
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C25H27N3O2S
Net Charge 0
Average Mass 433.568
Monoisotopic Mass 433.18240
InChI InChI=1S/C25H27N3O2S/c29-25-9-7-19-6-8-20(18-22(19)26-25)30-16-2-1-11-27-12-14-28(15-13-27)23-4-3-5-24-21(23)10-17-31-24/h3-10,17-18H,1-2,11-16H2,(H,26,29)
InChIKey ZKIAIYBUSXZPLP-UHFFFAOYSA-N
SMILES C1CN(CCN1CCCCOC2=CC3=C(C=C2)C=CC(N3)=O)C4=C5C(=CC=C4)SC=C5
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing brexpiprazole (CHEBI:134716) is a N-arylpiperazine (CHEBI:46848)
Synonyms Sources
OPC 34712 DrugCentral
OPC-34712 DrugCentral
rexulti DrugCentral
Manual Xref Database
5014 DrugCentral
View more database links
Registry Number Type Source
913611-97-9 CAS Registry Number DrugCentral
Last Modified
23 February 2017