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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1C(=O)CSC2=NN=C(C=C2)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC1CCCCN1C(=O)CSC2=NN=C(C=C2)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C20H25N3O3S/c1-14-6-4-5-11-23(14)20(24)13-27-19-10-8-16(21-22-19)15-7-9-17(25-2)18(12-15)26-3/h7-10,12,14H,4-6,11,13H2,1-3H3