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

Systemtic Name: 2-[4-(phenylcarbonyl)phenoxy]-1-[4-(6-thiophen-2-ylpyridazin-3-yl)piperazin-1-yl]ethanone Openeye Name: 2-(4-benzoylphenoxy)-1-[4-[6-(2-thienyl)pyridazin-3-yl]piperazin-1-yl]ethanone CAS Name: 2-(4-benzoylphenoxy)-1-[4-(6-thiophen-2-yl-3-pyridazinyl)-1-piperazinyl]ethanone IUPAC Name: 2-(4-benzoylphenoxy)-1-[4-(6-thiophen-2-ylpyridazin-3-yl)piperazin-1-yl]ethanone Traditional Name: 2-(4-benzoylphenoxy)-1-[4-[6-(2-thienyl)pyridazin-3-yl]piperazino]ethanone Formula: C27H24N4O3S MolecularWeight: 484.56946

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NN=C(C=C2)C3=CC=CS3)C(=O)COC4=CC=C(C=C4)C(=O)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C2=NN=C(C=C2)C3=CC=CS3)C(=O)COC4=CC=C(C=C4)C(=O)C5=CC=CC=C5

InChI

InChI=1S/C27H24N4O3S/c32-26(19-34-22-10-8-21(9-11-22)27(33)20-5-2-1-3-6-20)31-16-14-30(15-17-31)25-13-12-23(28-29-25)24-7-4-18-35-24/h1-13,18H,14-17,19H2