N-(4-methoxyphenyl)-1-[6-(4-methylphenyl)sulfanylpyridazin-3-yl]piperidine-4-carboxamide

Systemtic Name: N-(4-methoxyphenyl)-1-[6-(4-methylphenyl)sulfanylpyridazin-3-yl]piperidine-4-carboxamide Openeye Name: N-(4-methoxyphenyl)-1-[6-(p-tolylsulfanyl)pyridazin-3-yl]piperidine-4-carboxamide CAS Name: N-(4-methoxyphenyl)-1-[6-[(4-methylphenyl)thio]-3-pyridazinyl]-4-piperidinecarboxamide IUPAC Name: N-(4-methoxyphenyl)-1-[6-(4-methylphenyl)sulfanylpyridazin-3-yl]piperidine-4-carboxamide Traditional Name: N-(4-methoxyphenyl)-1-[6-(p-tolylthio)pyridazin-3-yl]isonipecotamide Formula: C24H26N4O2S MolecularWeight: 434.55384

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=NN=C(C=C2)N3CCC(CC3)C(=O)NC4=CC=C(C=C4)OC

Isomeric SMILES

CC1=CC=C(C=C1)SC2=NN=C(C=C2)N3CCC(CC3)C(=O)NC4=CC=C(C=C4)OC

InChI

InChI=1S/C24H26N4O2S/c1-17-3-9-21(10-4-17)31-23-12-11-22(26-27-23)28-15-13-18(14-16-28)24(29)25-19-5-7-20(30-2)8-6-19/h3-12,18H,13-16H2,1-2H3,(H,25,29)