ethyl 1-(4-azanyl-1,2,5-oxadiazol-3-yl)-5-(piperazin-1-ylmethyl)-1,2,3-triazole-4-carboxylate

Systemtic Name: ethyl 1-(4-azanyl-1,2,5-oxadiazol-3-yl)-5-(piperazin-1-ylmethyl)-1,2,3-triazole-4-carboxylate Openeye Name: ethyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(piperazin-1-ylmethyl)triazole-4-carboxylate CAS Name: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(1-piperazinylmethyl)-4-triazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(piperazin-1-ylmethyl)triazole-4-carboxylate Traditional Name: 1-(4-aminofurazan-3-yl)-5-(piperazinomethyl)triazole-4-carboxylic acid ethyl ester Formula: C12H18N8O3 MolecularWeight: 322.32312

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=N1)C2=NON=C2N)CN3CCNCC3

Isomeric SMILES

CCOC(=O)C1=C(N(N=N1)C2=NON=C2N)CN3CCNCC3

InChI

InChI=1S/C12H18N8O3/c1-2-22-12(21)9-8(7-19-5-3-14-4-6-19)20(18-15-9)11-10(13)16-23-17-11/h14H,2-7H2,1H3,(H2,13,16)