3-[[5-(3-piperidin-1-ylsulfonylphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]propanenitrile

Systemtic Name: 3-[[5-(3-piperidin-1-ylsulfonylphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]propanenitrile Openeye Name: 3-[[5-[3-(1-piperidylsulfonyl)phenyl]-1,3,4-oxadiazol-2-yl]sulfanyl]propanenitrile CAS Name: 3-[[5-[3-(1-piperidinylsulfonyl)phenyl]-1,3,4-oxadiazol-2-yl]thio]propanenitrile IUPAC Name: 3-[[5-(3-piperidin-1-ylsulfonylphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]propanenitrile Traditional Name: 3-[[5-(3-piperidinosulfonylphenyl)-1,3,4-oxadiazol-2-yl]thio]propionitrile Formula: C16H18N4O3S2 MolecularWeight: 378.46912

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C3=NN=C(O3)SCCC#N

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C3=NN=C(O3)SCCC#N

InChI

InChI=1S/C16H18N4O3S2/c17-8-5-11-24-16-19-18-15(23-16)13-6-4-7-14(12-13)25(21,22)20-9-2-1-3-10-20/h4,6-7,12H,1-3,5,9-11H2