methyl 4-[[3-chloranyl-6-(4-cyanophenyl)pyridazin-4-yl]carbonylamino]cyclohexane-1-carboxylate

Systemtic Name: methyl 4-[[3-chloranyl-6-(4-cyanophenyl)pyridazin-4-yl]carbonylamino]cyclohexane-1-carboxylate Openeye Name: methyl 4-[[3-chloro-6-(4-cyanophenyl)pyridazine-4-carbonyl]amino]cyclohexanecarboxylate CAS Name: 4-[[[3-chloro-6-(4-cyanophenyl)-4-pyridazinyl]-oxomethyl]amino]-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 4-[[3-chloro-6-(4-cyanophenyl)pyridazine-4-carbonyl]amino]cyclohexane-1-carboxylate Traditional Name: 4-[[3-chloro-6-(4-cyanophenyl)pyridazine-4-carbonyl]amino]cyclohexanecarboxylic acid methyl ester Formula: C20H19ClN4O3 MolecularWeight: 398.84286

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCC(CC1)NC(=O)C2=CC(=NN=C2Cl)C3=CC=C(C=C3)C#N

Isomeric SMILES

COC(=O)C1CCC(CC1)NC(=O)C2=CC(=NN=C2Cl)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C20H19ClN4O3/c1-28-20(27)14-6-8-15(9-7-14)23-19(26)16-10-17(24-25-18(16)21)13-4-2-12(11-22)3-5-13/h2-5,10,14-15H,6-9H2,1H3,(H,23,26)