N-(5-fluoranyl-2-methyl-phenyl)-5-[[6-oxidanylidene-3-(4-phenylpiperazin-1-yl)pyridazin-1-yl]methyl]furan-2-carboxamide

Systemtic Name: N-(5-fluoranyl-2-methyl-phenyl)-5-[[6-oxidanylidene-3-(4-phenylpiperazin-1-yl)pyridazin-1-yl]methyl]furan-2-carboxamide Openeye Name: N-(5-fluoro-2-methyl-phenyl)-5-[[6-oxo-3-(4-phenylpiperazin-1-yl)pyridazin-1-yl]methyl]furan-2-carboxamide CAS Name: N-(5-fluoro-2-methylphenyl)-5-[[6-oxo-3-(4-phenyl-1-piperazinyl)-1-pyridazinyl]methyl]-2-furancarboxamide IUPAC Name: N-(5-fluoro-2-methylphenyl)-5-[[6-oxo-3-(4-phenylpiperazin-1-yl)pyridazin-1-yl]methyl]furan-2-carboxamide Traditional Name: N-(5-fluoro-2-methyl-phenyl)-5-[[6-keto-3-(4-phenylpiperazino)pyridazin-1-yl]methyl]-2-furamide Formula: C27H26FN5O3 MolecularWeight: 487.525443

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)F)NC(=O)C2=CC=C(O2)CN3C(=O)C=CC(=N3)N4CCN(CC4)C5=CC=CC=C5

Isomeric SMILES

CC1=C(C=C(C=C1)F)NC(=O)C2=CC=C(O2)CN3C(=O)C=CC(=N3)N4CCN(CC4)C5=CC=CC=C5

InChI

InChI=1S/C27H26FN5O3/c1-19-7-8-20(28)17-23(19)29-27(35)24-10-9-22(36-24)18-33-26(34)12-11-25(30-33)32-15-13-31(14-16-32)21-5-3-2-4-6-21/h2-12,17H,13-16,18H2,1H3,(H,29,35)