[1-oxidanylidene-1-[(4-piperidin-1-ylphenyl)amino]propan-2-yl] 1-(6-ethoxypyridazin-3-yl)-5-methyl-pyrazole-4-carboxylate

Systemtic Name: [1-oxidanylidene-1-[(4-piperidin-1-ylphenyl)amino]propan-2-yl] 1-(6-ethoxypyridazin-3-yl)-5-methyl-pyrazole-4-carboxylate Openeye Name: [1-methyl-2-oxo-2-[4-(1-piperidyl)anilino]ethyl] 1-(6-ethoxypyridazin-3-yl)-5-methyl-pyrazole-4-carboxylate CAS Name: 1-(6-ethoxy-3-pyridazinyl)-5-methyl-4-pyrazolecarboxylic acid [1-oxo-1-[4-(1-piperidinyl)anilino]propan-2-yl] ester IUPAC Name: [1-oxo-1-(4-piperidin-1-ylanilino)propan-2-yl] 1-(6-ethoxypyridazin-3-yl)-5-methylpyrazole-4-carboxylate Traditional Name: 1-(6-ethoxypyridazin-3-yl)-5-methyl-pyrazole-4-carboxylic acid [2-keto-1-methyl-2-(4-piperidinoanilino)ethyl] ester Formula: C25H30N6O4 MolecularWeight: 478.5435

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NN=C(C=C1)N2C(=C(C=N2)C(=O)OC(C)C(=O)NC3=CC=C(C=C3)N4CCCCC4)C

Isomeric SMILES

CCOC1=NN=C(C=C1)N2C(=C(C=N2)C(=O)OC(C)C(=O)NC3=CC=C(C=C3)N4CCCCC4)C

InChI

InChI=1S/C25H30N6O4/c1-4-34-23-13-12-22(28-29-23)31-17(2)21(16-26-31)25(33)35-18(3)24(32)27-19-8-10-20(11-9-19)30-14-6-5-7-15-30/h8-13,16,18H,4-7,14-15H2,1-3H3,(H,27,32)