2-(3-piperidin-1-ylsulfonylphenyl)-5-(pyridin-3-ylmethylsulfanyl)-1,3,4-oxadiazole

Systemtic Name: 2-(3-piperidin-1-ylsulfonylphenyl)-5-(pyridin-3-ylmethylsulfanyl)-1,3,4-oxadiazole Openeye Name: 2-[3-(1-piperidylsulfonyl)phenyl]-5-(3-pyridylmethylsulfanyl)-1,3,4-oxadiazole CAS Name: 2-[3-(1-piperidinylsulfonyl)phenyl]-5-(3-pyridinylmethylthio)-1,3,4-oxadiazole IUPAC Name: 2-(3-piperidin-1-ylsulfonylphenyl)-5-(pyridin-3-ylmethylsulfanyl)-1,3,4-oxadiazole Traditional Name: 2-(3-piperidinosulfonylphenyl)-5-(3-pyridylmethylthio)-1,3,4-oxadiazole Formula: C19H20N4O3S2 MolecularWeight: 416.5171

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C3=NN=C(O3)SCC4=CN=CC=C4

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C3=NN=C(O3)SCC4=CN=CC=C4

InChI

InChI=1S/C19H20N4O3S2/c24-28(25,23-10-2-1-3-11-23)17-8-4-7-16(12-17)18-21-22-19(26-18)27-14-15-6-5-9-20-13-15/h4-9,12-13H,1-3,10-11,14H2