methyl 4-[[6-(4-cyanophenyl)-2-(2-morpholin-4-yl-2-oxidanylidene-ethyl)-3-oxidanylidene-pyridazin-4-yl]carbonylamino]cyclohexane-1-carboxylate

Systemtic Name: methyl 4-[[6-(4-cyanophenyl)-2-(2-morpholin-4-yl-2-oxidanylidene-ethyl)-3-oxidanylidene-pyridazin-4-yl]carbonylamino]cyclohexane-1-carboxylate Openeye Name: methyl 4-[[6-(4-cyanophenyl)-2-(2-morpholino-2-oxo-ethyl)-3-oxo-pyridazine-4-carbonyl]amino]cyclohexanecarboxylate CAS Name: 4-[[[6-(4-cyanophenyl)-2-[2-(4-morpholinyl)-2-oxoethyl]-3-oxo-4-pyridazinyl]-oxomethyl]amino]-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 4-[[6-(4-cyanophenyl)-2-(2-morpholin-4-yl-2-oxoethyl)-3-oxopyridazine-4-carbonyl]amino]cyclohexane-1-carboxylate Traditional Name: 4-[[6-(4-cyanophenyl)-3-keto-2-(2-keto-2-morpholino-ethyl)pyridazine-4-carbonyl]amino]cyclohexanecarboxylic acid methyl ester Formula: C26H29N5O6 MolecularWeight: 507.53836

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCC(CC1)NC(=O)C2=CC(=NN(C2=O)CC(=O)N3CCOCC3)C4=CC=C(C=C4)C#N

Isomeric SMILES

COC(=O)C1CCC(CC1)NC(=O)C2=CC(=NN(C2=O)CC(=O)N3CCOCC3)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C26H29N5O6/c1-36-26(35)19-6-8-20(9-7-19)28-24(33)21-14-22(18-4-2-17(15-27)3-5-18)29-31(25(21)34)16-23(32)30-10-12-37-13-11-30/h2-5,14,19-20H,6-13,16H2,1H3,(H,28,33)