CHEBI:122040 - 2-cyano-N-(1,1-dioxo-3-thiolanyl)-3-[2-(4-fluorophenoxy)-9-methyl-4-oxo-3-pyrido[1,2-a]pyrimidinyl]-2-propenamide

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ChEBI Name 2-cyano-N-(1,1-dioxo-3-thiolanyl)-3-[2-(4-fluorophenoxy)-9-methyl-4-oxo-3-pyrido[1,2-a]pyrimidinyl]-2-propenamide
ChEBI ID CHEBI:122040
Stars This entity has been manually annotated by a third party.
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Formula C23H19FN4O5S
Net Charge 0
Average Mass 482.486
Monoisotopic Mass 482.10602
InChI InChI=1S/C23H19FN4O5S/c1-14-3-2-9-28-20(14)27-22(33-18-6-4-16(24)5-7-18)19(23(28)30)11-15(12-25)21(29)26-17-8-10-34(31,32)13-17/h2-7,9,11,17H,8,10,13H2,1H3,(H,26,29)
InChIKey ANTLQBMMFPNGQF-UHFFFAOYSA-N
SMILES CC1=CC=CN2C1=NC(=C(C2=O)C=C(C#N)C(=O)NC3CCS(=O)(=O)C3)OC4=CC=C(C=C4)F
ChEBI Ontology
Outgoing 2-cyano-N-(1,1-dioxo-3-thiolanyl)-3-[2-(4-fluorophenoxy)-9-methyl-4-oxo-3-pyrido[1,2-a]pyrimidinyl]-2-propenamide (CHEBI:122040) is a aromatic ether (CHEBI:35618)
Manual Xref Database
LSM-33483 LINCS
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