CHEBI:123394 - 5-(3,5-dimethyl-6-oxo-1-cyclohexa-2,4-dienylidene)-N-[(4-methylphenyl)methyl]-1,2-dihydropyrazole-3-carboxamide

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 5-(3,5-dimethyl-6-oxo-1-cyclohexa-2,4-dienylidene)-N-[(4-methylphenyl)methyl]-1,2-dihydropyrazole-3-carboxamide
ChEBI ID CHEBI:123394
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C20H21N3O2
Net Charge 0
Average Mass 335.400
Monoisotopic Mass 335.16338
InChI InChI=1S/C20H21N3O2/c1-12-4-6-15(7-5-12)11-21-20(25)18-10-17(22-23-18)16-9-13(2)8-14(3)19(16)24/h4-10,22-23H,11H2,1-3H3,(H,21,25)
InChIKey LONJJDCCGDIEOB-UHFFFAOYSA-N
SMILES CC1=CC=C(C=C1)CNC(=O)C2=CC(=C3C=C(C=C(C3=O)C)C)NN2
ChEBI Ontology
Outgoing 5-(3,5-dimethyl-6-oxo-1-cyclohexa-2,4-dienylidene)-N-[(4-methylphenyl)methyl]-1,2-dihydropyrazole-3-carboxamide (CHEBI:123394) has functional parent α-amino acid (CHEBI:33704)
5-(3,5-dimethyl-6-oxo-1-cyclohexa-2,4-dienylidene)-N-[(4-methylphenyl)methyl]-1,2-dihydropyrazole-3-carboxamide (CHEBI:123394) is a organonitrogen compound (CHEBI:35352)
5-(3,5-dimethyl-6-oxo-1-cyclohexa-2,4-dienylidene)-N-[(4-methylphenyl)methyl]-1,2-dihydropyrazole-3-carboxamide (CHEBI:123394) is a organooxygen compound (CHEBI:36963)
Manual Xref Database
LSM-34836 LINCS
View more database links