1,3-benzodioxol-5-yl-[4-[6-(4-fluorophenyl)pyridazin-3-yl]piperazin-1-yl]methanone

Systemtic Name: 1,3-benzodioxol-5-yl-[4-[6-(4-fluorophenyl)pyridazin-3-yl]piperazin-1-yl]methanone Openeye Name: 1,3-benzodioxol-5-yl-[4-[6-(4-fluorophenyl)pyridazin-3-yl]piperazin-1-yl]methanone CAS Name: 1,3-benzodioxol-5-yl-[4-[6-(4-fluorophenyl)-3-pyridazinyl]-1-piperazinyl]methanone IUPAC Name: 1,3-benzodioxol-5-yl-[4-[6-(4-fluorophenyl)pyridazin-3-yl]piperazin-1-yl]methanone Traditional Name: 1,3-benzodioxol-5-yl-[4-[6-(4-fluorophenyl)pyridazin-3-yl]piperazino]methanone Formula: C22H19FN4O3 MolecularWeight: 406.409663

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NN=C(C=C2)C3=CC=C(C=C3)F)C(=O)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CN(CCN1C2=NN=C(C=C2)C3=CC=C(C=C3)F)C(=O)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C22H19FN4O3/c23-17-4-1-15(2-5-17)18-6-8-21(25-24-18)26-9-11-27(12-10-26)22(28)16-3-7-19-20(13-16)30-14-29-19/h1-8,13H,9-12,14H2