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

Systemtic Name: 1-(4-methoxyphenyl)-2-[6-(4-piperidin-1-ylphenyl)pyridazin-3-yl]sulfanyl-ethanone Openeye Name: 1-(4-methoxyphenyl)-2-[6-[4-(1-piperidyl)phenyl]pyridazin-3-yl]sulfanyl-ethanone CAS Name: 1-(4-methoxyphenyl)-2-[[6-[4-(1-piperidinyl)phenyl]-3-pyridazinyl]thio]ethanone IUPAC Name: 1-(4-methoxyphenyl)-2-[6-(4-piperidin-1-ylphenyl)pyridazin-3-yl]sulfanylethanone Traditional Name: 1-(4-methoxyphenyl)-2-[[6-(4-piperidinophenyl)pyridazin-3-yl]thio]ethanone Formula: C24H25N3O2S MolecularWeight: 419.5392

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)CSC2=NN=C(C=C2)C3=CC=C(C=C3)N4CCCCC4

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)CSC2=NN=C(C=C2)C3=CC=C(C=C3)N4CCCCC4

InChI

InChI=1S/C24H25N3O2S/c1-29-21-11-7-19(8-12-21)23(28)17-30-24-14-13-22(25-26-24)18-5-9-20(10-6-18)27-15-3-2-4-16-27/h5-14H,2-4,15-17H2,1H3