4-[1-(4-fluorophenyl)-6-oxidanylidene-pyridazin-3-yl]-N-(4-methoxyphenyl)piperazine-1-carboxamide

Systemtic Name: 4-[1-(4-fluorophenyl)-6-oxidanylidene-pyridazin-3-yl]-N-(4-methoxyphenyl)piperazine-1-carboxamide Openeye Name: 4-[1-(4-fluorophenyl)-6-oxo-pyridazin-3-yl]-N-(4-methoxyphenyl)piperazine-1-carboxamide CAS Name: 4-[1-(4-fluorophenyl)-6-oxo-3-pyridazinyl]-N-(4-methoxyphenyl)-1-piperazinecarboxamide IUPAC Name: 4-[1-(4-fluorophenyl)-6-oxopyridazin-3-yl]-N-(4-methoxyphenyl)piperazine-1-carboxamide Traditional Name: 4-[1-(4-fluorophenyl)-6-keto-pyridazin-3-yl]-N-(4-methoxyphenyl)piperazine-1-carboxamide Formula: C22H22FN5O3 MolecularWeight: 423.440183

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)N2CCN(CC2)C3=NN(C(=O)C=C3)C4=CC=C(C=C4)F

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)N2CCN(CC2)C3=NN(C(=O)C=C3)C4=CC=C(C=C4)F

InChI

InChI=1S/C22H22FN5O3/c1-31-19-8-4-17(5-9-19)24-22(30)27-14-12-26(13-15-27)20-10-11-21(29)28(25-20)18-6-2-16(23)3-7-18/h2-11H,12-15H2,1H3,(H,24,30)