1-[4-[6-(3,4-dimethoxyphenyl)pyridazin-3-yl]piperazin-1-yl]-2-thiophen-2-yl-ethanone

Systemtic Name: 1-[4-[6-(3,4-dimethoxyphenyl)pyridazin-3-yl]piperazin-1-yl]-2-thiophen-2-yl-ethanone Openeye Name: 1-[4-[6-(3,4-dimethoxyphenyl)pyridazin-3-yl]piperazin-1-yl]-2-(2-thienyl)ethanone CAS Name: 1-[4-[6-(3,4-dimethoxyphenyl)-3-pyridazinyl]-1-piperazinyl]-2-thiophen-2-ylethanone IUPAC Name: 1-[4-[6-(3,4-dimethoxyphenyl)pyridazin-3-yl]piperazin-1-yl]-2-thiophen-2-ylethanone Traditional Name: 1-[4-[6-(3,4-dimethoxyphenyl)pyridazin-3-yl]piperazino]-2-(2-thienyl)ethanone Formula: C22H24N4O3S MolecularWeight: 424.51596

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NN=C(C=C2)N3CCN(CC3)C(=O)CC4=CC=CS4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NN=C(C=C2)N3CCN(CC3)C(=O)CC4=CC=CS4)OC

InChI

InChI=1S/C22H24N4O3S/c1-28-19-7-5-16(14-20(19)29-2)18-6-8-21(24-23-18)25-9-11-26(12-10-25)22(27)15-17-4-3-13-30-17/h3-8,13-14H,9-12,15H2,1-2H3