2-[(4-chlorophenyl)methylsulfanyl]-5-(4-piperidin-1-ylsulfonylphenyl)-1,3,4-oxadiazole

Systemtic Name: 2-[(4-chlorophenyl)methylsulfanyl]-5-(4-piperidin-1-ylsulfonylphenyl)-1,3,4-oxadiazole Openeye Name: 2-[(4-chlorophenyl)methylsulfanyl]-5-[4-(1-piperidylsulfonyl)phenyl]-1,3,4-oxadiazole CAS Name: 2-[(4-chlorophenyl)methylthio]-5-[4-(1-piperidinylsulfonyl)phenyl]-1,3,4-oxadiazole IUPAC Name: 2-[(4-chlorophenyl)methylsulfanyl]-5-(4-piperidin-1-ylsulfonylphenyl)-1,3,4-oxadiazole Traditional Name: 2-[(4-chlorobenzyl)thio]-5-(4-piperidinosulfonylphenyl)-1,3,4-oxadiazole Formula: C20H20ClN3O3S2 MolecularWeight: 449.9741

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20ClN3O3S2/c21-17-8-4-15(5-9-17)14-28-20-23-22-19(27-20)16-6-10-18(11-7-16)29(25,26)24-12-2-1-3-13-24/h4-11H,1-3,12-14H2