1-piperidin-1-yl-2-(6-pyridin-3-ylpyridazin-3-yl)sulfanyl-ethanone

Systemtic Name: 1-piperidin-1-yl-2-(6-pyridin-3-ylpyridazin-3-yl)sulfanyl-ethanone Openeye Name: 1-(1-piperidyl)-2-[6-(3-pyridyl)pyridazin-3-yl]sulfanyl-ethanone CAS Name: 1-(1-piperidinyl)-2-[[6-(3-pyridinyl)-3-pyridazinyl]thio]ethanone IUPAC Name: 1-piperidin-1-yl-2-(6-pyridin-3-ylpyridazin-3-yl)sulfanylethanone Traditional Name: 1-piperidino-2-[[6-(3-pyridyl)pyridazin-3-yl]thio]ethanone Formula: C16H18N4OS MolecularWeight: 314.40532

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)CSC2=NN=C(C=C2)C3=CN=CC=C3

Isomeric SMILES

C1CCN(CC1)C(=O)CSC2=NN=C(C=C2)C3=CN=CC=C3

InChI

InChI=1S/C16H18N4OS/c21-16(20-9-2-1-3-10-20)12-22-15-7-6-14(18-19-15)13-5-4-8-17-11-13/h4-8,11H,1-3,9-10,12H2