CHEBI:104951 - 2-[4-[[4-(dimethylamino)phenyl]methylidene]-5-oxo-1-phenyl-3-pyrazolyl]acetic acid ethyl ester

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ChEBI Name 2-[4-[[4-(dimethylamino)phenyl]methylidene]-5-oxo-1-phenyl-3-pyrazolyl]acetic acid ethyl ester
ChEBI ID CHEBI:104951
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C22H23N3O3
Net Charge 0
Average Mass 377.437
Monoisotopic Mass 377.17394
InChI InChI=1S/C22H23N3O3/c1-4-28-21(26)15-20-19(14-16-10-12-17(13-11-16)24(2)3)22(27)25(23-20)18-8-6-5-7-9-18/h5-14H,4,15H2,1-3H3
InChIKey QQKRCQSFGQFOBF-UHFFFAOYSA-N
SMILES CCOC(=O)CC1=NN(C(=O)C1=CC2=CC=C(C=C2)N(C)C)C3=CC=CC=C3
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
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ChEBI Ontology
Outgoing 2-[4-[[4-(dimethylamino)phenyl]methylidene]-5-oxo-1-phenyl-3-pyrazolyl]acetic acid ethyl ester (CHEBI:104951) is a dialkylarylamine (CHEBI:23665)
2-[4-[[4-(dimethylamino)phenyl]methylidene]-5-oxo-1-phenyl-3-pyrazolyl]acetic acid ethyl ester (CHEBI:104951) is a tertiary amino compound (CHEBI:50996)
Manual Xref Database
LSM-16314 LINCS
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