2-[6-(2,5-dimethoxyphenyl)pyridazin-3-yl]sulfanyl-1-(4-methylpiperidin-1-yl)ethanone

Systemtic Name: 2-[6-(2,5-dimethoxyphenyl)pyridazin-3-yl]sulfanyl-1-(4-methylpiperidin-1-yl)ethanone Openeye Name: 2-[6-(2,5-dimethoxyphenyl)pyridazin-3-yl]sulfanyl-1-(4-methyl-1-piperidyl)ethanone CAS Name: 2-[[6-(2,5-dimethoxyphenyl)-3-pyridazinyl]thio]-1-(4-methyl-1-piperidinyl)ethanone IUPAC Name: 2-[6-(2,5-dimethoxyphenyl)pyridazin-3-yl]sulfanyl-1-(4-methylpiperidin-1-yl)ethanone Traditional Name: 2-[[6-(2,5-dimethoxyphenyl)pyridazin-3-yl]thio]-1-(4-methylpiperidino)ethanone Formula: C20H25N3O3S MolecularWeight: 387.4958

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)CSC2=NN=C(C=C2)C3=C(C=CC(=C3)OC)OC

Isomeric SMILES

CC1CCN(CC1)C(=O)CSC2=NN=C(C=C2)C3=C(C=CC(=C3)OC)OC

InChI

InChI=1S/C20H25N3O3S/c1-14-8-10-23(11-9-14)20(24)13-27-19-7-5-17(21-22-19)16-12-15(25-2)4-6-18(16)26-3/h4-7,12,14H,8-11,13H2,1-3H3