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

Systemtic Name: 2-(3-phenoxypropylsulfanyl)-5-(3-piperidin-1-ylsulfonylphenyl)-1,3,4-oxadiazole Openeye Name: 2-(3-phenoxypropylsulfanyl)-5-[3-(1-piperidylsulfonyl)phenyl]-1,3,4-oxadiazole CAS Name: 2-(3-phenoxypropylthio)-5-[3-(1-piperidinylsulfonyl)phenyl]-1,3,4-oxadiazole IUPAC Name: 2-(3-phenoxypropylsulfanyl)-5-(3-piperidin-1-ylsulfonylphenyl)-1,3,4-oxadiazole Traditional Name: 2-(3-phenoxypropylthio)-5-(3-piperidinosulfonylphenyl)-1,3,4-oxadiazole Formula: C22H25N3O4S2 MolecularWeight: 459.5816

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C3=NN=C(O3)SCCCOC4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C3=NN=C(O3)SCCCOC4=CC=CC=C4

InChI

InChI=1S/C22H25N3O4S2/c26-31(27,25-13-5-2-6-14-25)20-12-7-9-18(17-20)21-23-24-22(29-21)30-16-8-15-28-19-10-3-1-4-11-19/h1,3-4,7,9-12,17H,2,5-6,8,13-16H2