3-(3-methoxyphenyl)-6-(2-piperidin-1-ium-1-ylethylsulfanyl)pyridazine

Systemtic Name: 3-(3-methoxyphenyl)-6-(2-piperidin-1-ium-1-ylethylsulfanyl)pyridazine Openeye Name: 3-(3-methoxyphenyl)-6-(2-piperidin-1-ium-1-ylethylsulfanyl)pyridazine CAS Name: 3-(3-methoxyphenyl)-6-[2-(1-piperidin-1-iumyl)ethylthio]pyridazine IUPAC Name: 3-(3-methoxyphenyl)-6-(2-piperidin-1-ium-1-ylethylsulfanyl)pyridazine Traditional Name: 3-(3-methoxyphenyl)-6-(2-piperidin-1-ium-1-ylethylthio)pyridazine Formula: C18H24N3OS+ MolecularWeight: 330.46766

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=NN=C(C=C2)SCC[NH+]3CCCCC3

Isomeric SMILES

COC1=CC=CC(=C1)C2=NN=C(C=C2)SCC[NH+]3CCCCC3

InChI

InChI=1S/C18H23N3OS/c1-22-16-7-5-6-15(14-16)17-8-9-18(20-19-17)23-13-12-21-10-3-2-4-11-21/h5-9,14H,2-4,10-13H2,1H3/p+1