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CHEBI:107403 - 4-amino-N5-[2-(4-morpholinyl)ethyl]-N5-[1-oxo-1-[(phenylmethyl)amino]propan-2-yl]isothiazole-3,5-dicarboxamide

ChEBI IDCHEBI:107403
ChEBI Name4-amino-N5-[2-(4-morpholinyl)ethyl]-N5-[1-oxo-1-[(phenylmethyl)amino]propan-2-yl]isothiazole-3,5-dicarboxamide
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FormulaC21H28N6O4S
Net Charge0
Average Mass460.560
Monoisotopic Mass460.18927
SMILESCC(C(=O)NCc1ccccc1)N(CCN1CCOCC1)C(=O)c1snc(C(N)=O)c1N
InChIInChI=1S/C21H28N6O4S/c1-14(20(29)24-13-15-5-3-2-4-6-15)27(8-7-26-9-11-31-12-10-26)21(30)18-16(22)17(19(23)28)25-32-18/h2-6,14H,7-13,22H2,1H3,(H2,23,28)(H,24,29)
InChIKeyDJFINWFRGRKWLZ-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
4-amino-N5-[2-(4-morpholinyl)ethyl]-N5-[1-oxo-1-[(phenylmethyl)amino]propan-2-yl]isothiazole-3,5-dicarboxamide (CHEBI:107403) is a alanine derivative (CHEBI:22278)
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