ethyl 4-[5-methyl-1-(6-oxidanylidene-1H-pyridazin-3-yl)pyrazol-4-yl]carbonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[5-methyl-1-(6-oxidanylidene-1H-pyridazin-3-yl)pyrazol-4-yl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[5-methyl-1-(6-oxo-1H-pyridazin-3-yl)pyrazole-4-carbonyl]piperazine-1-carboxylate CAS Name: 4-[[5-methyl-1-(6-oxo-1H-pyridazin-3-yl)-4-pyrazolyl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[5-methyl-1-(6-oxo-1H-pyridazin-3-yl)pyrazole-4-carbonyl]piperazine-1-carboxylate Traditional Name: 4-[1-(6-keto-1H-pyridazin-3-yl)-5-methyl-pyrazole-4-carbonyl]piperazine-1-carboxylic acid ethyl ester Formula: C16H20N6O4 MolecularWeight: 360.3678

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2=C(N(N=C2)C3=NNC(=O)C=C3)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2=C(N(N=C2)C3=NNC(=O)C=C3)C

InChI

InChI=1S/C16H20N6O4/c1-3-26-16(25)21-8-6-20(7-9-21)15(24)12-10-17-22(11(12)2)13-4-5-14(23)19-18-13/h4-5,10H,3,6-9H2,1-2H3,(H,19,23)