4-[[3-(8-methoxyquinazolin-2-yl)oxyphenyl]methylidene]-N-pyridazin-3-yl-piperidine-1-carboxamide

Systemtic Name: 4-[[3-(8-methoxyquinazolin-2-yl)oxyphenyl]methylidene]-N-pyridazin-3-yl-piperidine-1-carboxamide Openeye Name: 4-[[3-(8-methoxyquinazolin-2-yl)oxyphenyl]methylene]-N-pyridazin-3-yl-piperidine-1-carboxamide CAS Name: 4-[[3-[(8-methoxy-2-quinazolinyl)oxy]phenyl]methylidene]-N-(3-pyridazinyl)-1-piperidinecarboxamide IUPAC Name: 4-[[3-(8-methoxyquinazolin-2-yl)oxyphenyl]methylidene]-N-pyridazin-3-ylpiperidine-1-carboxamide Traditional Name: 4-[3-(8-methoxyquinazolin-2-yl)oxybenzylidene]-N-pyridazin-3-yl-piperidine-1-carboxamide Formula: C26H24N6O3 MolecularWeight: 468.50716

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=CN=C(N=C21)OC3=CC=CC(=C3)C=C4CCN(CC4)C(=O)NC5=NN=CC=C5

Isomeric SMILES

COC1=CC=CC2=CN=C(N=C21)OC3=CC=CC(=C3)C=C4CCN(CC4)C(=O)NC5=NN=CC=C5

InChI

InChI=1S/C26H24N6O3/c1-34-22-8-3-6-20-17-27-25(30-24(20)22)35-21-7-2-5-19(16-21)15-18-10-13-32(14-11-18)26(33)29-23-9-4-12-28-31-23/h2-9,12,15-17H,10-11,13-14H2,1H3,(H,29,31,33)