2-[6-(4-piperidin-1-ylphenyl)pyridazin-3-yl]sulfanylethanenitrile

Systemtic Name: 2-[6-(4-piperidin-1-ylphenyl)pyridazin-3-yl]sulfanylethanenitrile Openeye Name: 2-[6-[4-(1-piperidyl)phenyl]pyridazin-3-yl]sulfanylacetonitrile CAS Name: 2-[[6-[4-(1-piperidinyl)phenyl]-3-pyridazinyl]thio]acetonitrile IUPAC Name: 2-[6-(4-piperidin-1-ylphenyl)pyridazin-3-yl]sulfanylacetonitrile Traditional Name: 2-[[6-(4-piperidinophenyl)pyridazin-3-yl]thio]acetonitrile Formula: C17H18N4S MolecularWeight: 310.41662

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=CC=C(C=C2)C3=NN=C(C=C3)SCC#N

Isomeric SMILES

C1CCN(CC1)C2=CC=C(C=C2)C3=NN=C(C=C3)SCC#N

InChI

InChI=1S/C17H18N4S/c18-10-13-22-17-9-8-16(19-20-17)14-4-6-15(7-5-14)21-11-2-1-3-12-21/h4-9H,1-3,11-13H2