CHEBI:105706 - 4-[[oxo-(1-phenyl-3-pyridin-4-yl-4-pyrazolyl)methyl]amino]benzoic acid methyl ester

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 4-[[oxo-(1-phenyl-3-pyridin-4-yl-4-pyrazolyl)methyl]amino]benzoic acid methyl ester
ChEBI ID CHEBI:105706
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C23H18N4O3
Net Charge 0
Average Mass 398.415
Monoisotopic Mass 398.13789
InChI InChI=1S/C23H18N4O3/c1-30-23(29)17-7-9-18(10-8-17)25-22(28)20-15-27(19-5-3-2-4-6-19)26-21(20)16-11-13-24-14-12-16/h2-15H,1H3,(H,25,28)
InChIKey GAMGAUOEAAYTOE-UHFFFAOYSA-N
SMILES COC(=O)C1=CC=C(C=C1)NC(=O)C2=CN(N=C2C3=CC=NC=C3)C4=CC=CC=C4
ChEBI Ontology
Outgoing 4-[[oxo-(1-phenyl-3-pyridin-4-yl-4-pyrazolyl)methyl]amino]benzoic acid methyl ester (CHEBI:105706) is a aromatic amide (CHEBI:62733)
Manual Xref Database
LSM-17068 LINCS
View more database links