ethyl 4-(2-ethoxy-2-oxidanylidene-ethyl)-8-phenyl-7-propan-2-yl-pyrazolo[5,1-c][1,2,4]triazine-3-carboxylate

Systemtic Name: ethyl 4-(2-ethoxy-2-oxidanylidene-ethyl)-8-phenyl-7-propan-2-yl-pyrazolo[5,1-c][1,2,4]triazine-3-carboxylate Openeye Name: ethyl 4-(2-ethoxy-2-oxo-ethyl)-7-isopropyl-8-phenyl-pyrazolo[5,1-c][1,2,4]triazine-3-carboxylate CAS Name: 4-(2-ethoxy-2-oxoethyl)-8-phenyl-7-propan-2-yl-3-pyrazolo[5,1-c][1,2,4]triazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(2-ethoxy-2-oxoethyl)-8-phenyl-7-propan-2-ylpyrazolo[5,1-c][1,2,4]triazine-3-carboxylate Traditional Name: 4-(2-ethoxy-2-keto-ethyl)-7-isopropyl-8-phenyl-pyrazolo[5,1-c][1,2,4]triazine-3-carboxylic acid ethyl ester Formula: C21H24N4O4 MolecularWeight: 396.43966

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=C(N=NC2=C(C(=NN12)C(C)C)C3=CC=CC=C3)C(=O)OCC

Isomeric SMILES

CCOC(=O)CC1=C(N=NC2=C(C(=NN12)C(C)C)C3=CC=CC=C3)C(=O)OCC

InChI

InChI=1S/C21H24N4O4/c1-5-28-16(26)12-15-19(21(27)29-6-2)22-23-20-17(14-10-8-7-9-11-14)18(13(3)4)24-25(15)20/h7-11,13H,5-6,12H2,1-4H3