2-(1,3-benzodioxol-5-yloxy)-1-[4-(6-thiophen-2-ylpyridazin-3-yl)piperazin-1-yl]ethanone

Systemtic Name: 2-(1,3-benzodioxol-5-yloxy)-1-[4-(6-thiophen-2-ylpyridazin-3-yl)piperazin-1-yl]ethanone Openeye Name: 2-(1,3-benzodioxol-5-yloxy)-1-[4-[6-(2-thienyl)pyridazin-3-yl]piperazin-1-yl]ethanone CAS Name: 2-(1,3-benzodioxol-5-yloxy)-1-[4-(6-thiophen-2-yl-3-pyridazinyl)-1-piperazinyl]ethanone IUPAC Name: 2-(1,3-benzodioxol-5-yloxy)-1-[4-(6-thiophen-2-ylpyridazin-3-yl)piperazin-1-yl]ethanone Traditional Name: 2-(1,3-benzodioxol-5-yloxy)-1-[4-[6-(2-thienyl)pyridazin-3-yl]piperazino]ethanone Formula: C21H20N4O4S MolecularWeight: 424.4729

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NN=C(C=C2)C3=CC=CS3)C(=O)COC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CN(CCN1C2=NN=C(C=C2)C3=CC=CS3)C(=O)COC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C21H20N4O4S/c26-21(13-27-15-3-5-17-18(12-15)29-14-28-17)25-9-7-24(8-10-25)20-6-4-16(22-23-20)19-2-1-11-30-19/h1-6,11-12H,7-10,13-14H2