2-(3-methylphenoxy)-1-[4-(6-thiophen-2-ylpyridazin-3-yl)piperazin-1-yl]ethanone

Systemtic Name: 2-(3-methylphenoxy)-1-[4-(6-thiophen-2-ylpyridazin-3-yl)piperazin-1-yl]ethanone Openeye Name: 2-(3-methylphenoxy)-1-[4-[6-(2-thienyl)pyridazin-3-yl]piperazin-1-yl]ethanone CAS Name: 2-(3-methylphenoxy)-1-[4-(6-thiophen-2-yl-3-pyridazinyl)-1-piperazinyl]ethanone IUPAC Name: 2-(3-methylphenoxy)-1-[4-(6-thiophen-2-ylpyridazin-3-yl)piperazin-1-yl]ethanone Traditional Name: 2-(3-methylphenoxy)-1-[4-[6-(2-thienyl)pyridazin-3-yl]piperazino]ethanone Formula: C21H22N4O2S MolecularWeight: 394.48998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCC(=O)N2CCN(CC2)C3=NN=C(C=C3)C4=CC=CS4

Isomeric SMILES

CC1=CC(=CC=C1)OCC(=O)N2CCN(CC2)C3=NN=C(C=C3)C4=CC=CS4

InChI

InChI=1S/C21H22N4O2S/c1-16-4-2-5-17(14-16)27-15-21(26)25-11-9-24(10-12-25)20-8-7-18(22-23-20)19-6-3-13-28-19/h2-8,13-14H,9-12,15H2,1H3