ethyl 1-(4-azanyl-1,2,5-oxadiazol-3-yl)-5-[[(2,4-dimethoxyphenyl)amino]methyl]-1,2,3-triazole-4-carboxylate

Systemtic Name: ethyl 1-(4-azanyl-1,2,5-oxadiazol-3-yl)-5-[[(2,4-dimethoxyphenyl)amino]methyl]-1,2,3-triazole-4-carboxylate Openeye Name: ethyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(2,4-dimethoxyanilino)methyl]triazole-4-carboxylate CAS Name: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(2,4-dimethoxyanilino)methyl]-4-triazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(2,4-dimethoxyanilino)methyl]triazole-4-carboxylate Traditional Name: 1-(4-aminofurazan-3-yl)-5-[(2,4-dimethoxyanilino)methyl]triazole-4-carboxylic acid ethyl ester Formula: C16H19N7O5 MolecularWeight: 389.36596

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=N1)C2=NON=C2N)CNC3=C(C=C(C=C3)OC)OC

Isomeric SMILES

CCOC(=O)C1=C(N(N=N1)C2=NON=C2N)CNC3=C(C=C(C=C3)OC)OC

InChI

InChI=1S/C16H19N7O5/c1-4-27-16(24)13-11(23(22-19-13)15-14(17)20-28-21-15)8-18-10-6-5-9(25-2)7-12(10)26-3/h5-7,18H,4,8H2,1-3H3,(H2,17,20)