4-[6-(1,3-benzodioxol-5-yl)pyridazin-3-yl]-N-(2-fluorophenyl)piperazine-1-carboxamide

Systemtic Name: 4-[6-(1,3-benzodioxol-5-yl)pyridazin-3-yl]-N-(2-fluorophenyl)piperazine-1-carboxamide Openeye Name: 4-[6-(1,3-benzodioxol-5-yl)pyridazin-3-yl]-N-(2-fluorophenyl)piperazine-1-carboxamide CAS Name: 4-[6-(1,3-benzodioxol-5-yl)-3-pyridazinyl]-N-(2-fluorophenyl)-1-piperazinecarboxamide IUPAC Name: 4-[6-(1,3-benzodioxol-5-yl)pyridazin-3-yl]-N-(2-fluorophenyl)piperazine-1-carboxamide Traditional Name: 4-[6-(1,3-benzodioxol-5-yl)pyridazin-3-yl]-N-(2-fluorophenyl)piperazine-1-carboxamide Formula: C22H20FN5O3 MolecularWeight: 421.424303

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NN=C(C=C2)C3=CC4=C(C=C3)OCO4)C(=O)NC5=CC=CC=C5F

Isomeric SMILES

C1CN(CCN1C2=NN=C(C=C2)C3=CC4=C(C=C3)OCO4)C(=O)NC5=CC=CC=C5F

InChI

InChI=1S/C22H20FN5O3/c23-16-3-1-2-4-18(16)24-22(29)28-11-9-27(10-12-28)21-8-6-17(25-26-21)15-5-7-19-20(13-15)31-14-30-19/h1-8,13H,9-12,14H2,(H,24,29)