2-[2-(3-chloranylphenoxy)ethylsulfanyl]-5-(3-piperidin-1-ylsulfonylphenyl)-1,3,4-oxadiazole

Systemtic Name: 2-[2-(3-chloranylphenoxy)ethylsulfanyl]-5-(3-piperidin-1-ylsulfonylphenyl)-1,3,4-oxadiazole Openeye Name: 2-[2-(3-chlorophenoxy)ethylsulfanyl]-5-[3-(1-piperidylsulfonyl)phenyl]-1,3,4-oxadiazole CAS Name: 2-[2-(3-chlorophenoxy)ethylthio]-5-[3-(1-piperidinylsulfonyl)phenyl]-1,3,4-oxadiazole IUPAC Name: 2-[2-(3-chlorophenoxy)ethylsulfanyl]-5-(3-piperidin-1-ylsulfonylphenyl)-1,3,4-oxadiazole Traditional Name: 2-[2-(3-chlorophenoxy)ethylthio]-5-(3-piperidinosulfonylphenyl)-1,3,4-oxadiazole Formula: C21H22ClN3O4S2 MolecularWeight: 480.00008

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C3=NN=C(O3)SCCOC4=CC(=CC=C4)Cl

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C3=NN=C(O3)SCCOC4=CC(=CC=C4)Cl

InChI

InChI=1S/C21H22ClN3O4S2/c22-17-7-5-8-18(15-17)28-12-13-30-21-24-23-20(29-21)16-6-4-9-19(14-16)31(26,27)25-10-2-1-3-11-25/h4-9,14-15H,1-3,10-13H2