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CHEBI:114727 - N-[3-[1-cyano-2-[2-(4-methoxyphenyl)ethylamino]-2-oxoethylidene]-1-isoindolyl]-2-thiophenecarboxamide

ChEBI IDCHEBI:114727
ChEBI NameN-[3-[1-cyano-2-[2-(4-methoxyphenyl)ethylamino]-2-oxoethylidene]-1-isoindolyl]-2-thiophenecarboxamide
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FormulaC25H20N4O3S
Net Charge0
Average Mass456.527
Monoisotopic Mass456.12561
SMILESCOc1ccc(CCNC(=O)C(C#N)=C2N=C(NC(=O)c3cccs3)c3ccccc32)cc1
InChIInChI=1S/C25H20N4O3S/c1-32-17-10-8-16(9-11-17)12-13-27-24(30)20(15-26)22-18-5-2-3-6-19(18)23(28-22)29-25(31)21-7-4-14-33-21/h2-11,14H,12-13H2,1H3,(H,27,30)(H,28,29,31)
InChIKeyVCCGQFJXGMRRHV-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[3-[1-cyano-2-[2-(4-methoxyphenyl)ethylamino]-2-oxoethylidene]-1-isoindolyl]-2-thiophenecarboxamide (CHEBI:114727) is a isoindoles (CHEBI:24897)
Manual XrefsDatabases
LSM-26189LINCS