CHEBI:123220 - 2-cyano-N-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-3-[9-methyl-2-(2-methylphenoxy)-4-oxo-3-pyrido[1,2-a]pyrimidinyl]-2-propenamide

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ChEBI Name 2-cyano-N-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-3-[9-methyl-2-(2-methylphenoxy)-4-oxo-3-pyrido[1,2-a]pyrimidinyl]-2-propenamide
ChEBI ID CHEBI:123220
Stars This entity has been manually annotated by a third party.
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Formula C31H26N6O4
Net Charge 0
Average Mass 546.577
Monoisotopic Mass 546.20155
InChI InChI=1S/C31H26N6O4/c1-19-11-8-9-15-25(19)41-29-24(30(39)36-16-10-12-20(2)27(36)34-29)17-22(18-32)28(38)33-26-21(3)35(4)37(31(26)40)23-13-6-5-7-14-23/h5-17H,1-4H3,(H,33,38)
InChIKey HQQPWBLJSLTCET-UHFFFAOYSA-N
SMILES CC1=CC=CC=C1OC2=C(C(=O)N3C=CC=C(C3=N2)C)C=C(C#N)C(=O)NC4=C(N(N(C4=O)C5=CC=CC=C5)C)C
ChEBI Ontology
Outgoing 2-cyano-N-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-3-[9-methyl-2-(2-methylphenoxy)-4-oxo-3-pyrido[1,2-a]pyrimidinyl]-2-propenamide (CHEBI:123220) is a pyrazoles (CHEBI:26410)
2-cyano-N-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-3-[9-methyl-2-(2-methylphenoxy)-4-oxo-3-pyrido[1,2-a]pyrimidinyl]-2-propenamide (CHEBI:123220) is a ring assembly (CHEBI:36820)
Manual Xref Database
LSM-34662 LINCS
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