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CHEBI:95243 - 1-(4-amino-1,2,5-oxadiazol-3-yl)-N-[(2-bromophenyl)methylideneamino]-5-(1-pyrrolidinylmethyl)-4-triazolecarboxamide

Default Structure
ChEBI IDCHEBI:95243
ChEBI Name1-(4-amino-1,2,5-oxadiazol-3-yl)-N-[(2-bromophenyl)methylideneamino]-5-(1-pyrrolidinylmethyl)-4-triazolecarboxamide
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FormulaC17H18BrN9O2
Net Charge0
Average Mass460.296
Monoisotopic Mass459.07668
SMILESNc1nonc1-n1nnc(C(=O)NN=Cc2ccccc2Br)c1CN1CCCC1
InChIInChI=1S/C17H18BrN9O2/c18-12-6-2-1-5-11(12)9-20-22-17(28)14-13(10-26-7-3-4-8-26)27(25-21-14)16-15(19)23-29-24-16/h1-2,5-6,9H,3-4,7-8,10H2,(H2,19,23)(H,22,28)
InChIKeyAFJWJNWNXFMXPZ-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
1-(4-amino-1,2,5-oxadiazol-3-yl)-N-[(2-bromophenyl)methylideneamino]-5-(1-pyrrolidinylmethyl)-4-triazolecarboxamide (CHEBI:95243) is a organobromine compound (CHEBI:37141)
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