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CHEBI:108042 - 6-amino-5-cyano-2-[[(3-cyano-4,6-dimethyl-2-pyridinyl)thio]methyl]-4-phenyl-4H-pyran-3-carboxylic acid ethyl ester

ChEBI IDCHEBI:108042
ChEBI Name6-amino-5-cyano-2-[[(3-cyano-4,6-dimethyl-2-pyridinyl)thio]methyl]-4-phenyl-4H-pyran-3-carboxylic acid ethyl ester
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DownloadsMolfile
FormulaC24H22N4O3S
Net Charge0
Average Mass446.532
Monoisotopic Mass446.14126
SMILESCCOC(=O)C1=C(CSc2nc(C)cc(C)c2C#N)OC(N)=C(C#N)C1c1ccccc1
InChIInChI=1S/C24H22N4O3S/c1-4-30-24(29)21-19(13-32-23-17(11-25)14(2)10-15(3)28-23)31-22(27)18(12-26)20(21)16-8-6-5-7-9-16/h5-10,20H,4,13,27H2,1-3H3
InChIKeyRTKWILSYKYJSQX-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
6-amino-5-cyano-2-[[(3-cyano-4,6-dimethyl-2-pyridinyl)thio]methyl]-4-phenyl-4H-pyran-3-carboxylic acid ethyl ester (CHEBI:108042) is a aryl sulfide (CHEBI:35683)
Manual XrefsDatabases
LSM-19419LINCS