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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C(=O)CSC2=NN=C(C=C2)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

C[C@H]1CCCN(C1)C(=O)CSC2=NN=C(C=C2)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C20H25N3O3S/c1-14-5-4-10-23(12-14)20(24)13-27-19-9-7-16(21-22-19)15-6-8-17(25-2)18(11-15)26-3/h6-9,11,14H,4-5,10,12-13H2,1-3H3/t14-/m0/s1