1-(4-phenylpiperazin-1-yl)-2-[6-(4-piperidin-1-ylphenyl)pyridazin-3-yl]sulfanyl-ethanone

Systemtic Name: 1-(4-phenylpiperazin-1-yl)-2-[6-(4-piperidin-1-ylphenyl)pyridazin-3-yl]sulfanyl-ethanone Openeye Name: 1-(4-phenylpiperazin-1-yl)-2-[6-[4-(1-piperidyl)phenyl]pyridazin-3-yl]sulfanyl-ethanone CAS Name: 1-(4-phenyl-1-piperazinyl)-2-[[6-[4-(1-piperidinyl)phenyl]-3-pyridazinyl]thio]ethanone IUPAC Name: 1-(4-phenylpiperazin-1-yl)-2-[6-(4-piperidin-1-ylphenyl)pyridazin-3-yl]sulfanylethanone Traditional Name: 1-(4-phenylpiperazino)-2-[[6-(4-piperidinophenyl)pyridazin-3-yl]thio]ethanone Formula: C27H31N5OS MolecularWeight: 473.63294

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=CC=C(C=C2)C3=NN=C(C=C3)SCC(=O)N4CCN(CC4)C5=CC=CC=C5

Isomeric SMILES

C1CCN(CC1)C2=CC=C(C=C2)C3=NN=C(C=C3)SCC(=O)N4CCN(CC4)C5=CC=CC=C5

InChI

InChI=1S/C27H31N5OS/c33-27(32-19-17-31(18-20-32)23-7-3-1-4-8-23)21-34-26-14-13-25(28-29-26)22-9-11-24(12-10-22)30-15-5-2-6-16-30/h1,3-4,7-14H,2,5-6,15-21H2