1-[4-(2-methoxyphenyl)piperazin-1-yl]-2-[6-(4-phenylphenyl)pyridazin-3-yl]sulfanyl-ethanone

Systemtic Name: 1-[4-(2-methoxyphenyl)piperazin-1-yl]-2-[6-(4-phenylphenyl)pyridazin-3-yl]sulfanyl-ethanone Openeye Name: 1-[4-(2-methoxyphenyl)piperazin-1-yl]-2-[6-(4-phenylphenyl)pyridazin-3-yl]sulfanyl-ethanone CAS Name: 1-[4-(2-methoxyphenyl)-1-piperazinyl]-2-[[6-(4-phenylphenyl)-3-pyridazinyl]thio]ethanone IUPAC Name: 1-[4-(2-methoxyphenyl)piperazin-1-yl]-2-[6-(4-phenylphenyl)pyridazin-3-yl]sulfanylethanone Traditional Name: 1-[4-(2-methoxyphenyl)piperazino]-2-[[6-(4-phenylphenyl)pyridazin-3-yl]thio]ethanone Formula: C29H28N4O2S MolecularWeight: 496.62322

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)C(=O)CSC3=NN=C(C=C3)C4=CC=C(C=C4)C5=CC=CC=C5

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)C(=O)CSC3=NN=C(C=C3)C4=CC=C(C=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H28N4O2S/c1-35-27-10-6-5-9-26(27)32-17-19-33(20-18-32)29(34)21-36-28-16-15-25(30-31-28)24-13-11-23(12-14-24)22-7-3-2-4-8-22/h2-16H,17-21H2,1H3