CHEBI:95272 - 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(1-azepanylmethyl)-N-[(2-ethoxyphenyl)methylideneamino]-4-triazolecarboxamide

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ChEBI Name 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(1-azepanylmethyl)-N-[(2-ethoxyphenyl)methylideneamino]-4-triazolecarboxamide
ChEBI ID CHEBI:95272
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C21H27N9O3
Net Charge 0
Average Mass 453.498
Monoisotopic Mass 453.22369
InChI InChI=1S/C21H27N9O3/c1-2-32-17-10-6-5-9-15(17)13-23-25-21(31)18-16(14-29-11-7-3-4-8-12-29)30(28-24-18)20-19(22)26-33-27-20/h5-6,9-10,13H,2-4,7-8,11-12,14H2,1H3,(H2,22,26)(H,25,31)
InChIKey DOVIZHGISHYASN-UHFFFAOYSA-N
SMILES CCOC1=CC=CC=C1C=NNC(=O)C2=C(N(N=N2)C3=NON=C3N)CN4CCCCCC4
ChEBI Ontology
Outgoing 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(1-azepanylmethyl)-N-[(2-ethoxyphenyl)methylideneamino]-4-triazolecarboxamide (CHEBI:95272) is a aromatic ether (CHEBI:35618)
Manual Xref Database
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