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CHEBI:112852 - 2-(5-amino-1-phenyl-1,2,4-triazol-3-yl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione

ChEBI IDCHEBI:112852
ChEBI Name2-(5-amino-1-phenyl-1,2,4-triazol-3-yl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione
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DownloadsMolfile
FormulaC16H15N5O2
Net Charge0
Average Mass309.329
Monoisotopic Mass309.12257
SMILESNc1nc(N2C(=O)C3CC=CCC3C2=O)nn1-c1ccccc1
InChIInChI=1S/C16H15N5O2/c17-15-18-16(19-21(15)10-6-2-1-3-7-10)20-13(22)11-8-4-5-9-12(11)14(20)23/h1-7,11-12H,8-9H2,(H2,17,18,19)
InChIKeyBRQJUXMVCVVPRO-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
2-(5-amino-1-phenyl-1,2,4-triazol-3-yl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione (CHEBI:112852) is a triazoles (CHEBI:35727)
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