2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-5-(4-piperidin-1-ylsulfonylphenyl)-1,3,4-oxadiazole

Systemtic Name: 2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-5-(4-piperidin-1-ylsulfonylphenyl)-1,3,4-oxadiazole Openeye Name: 2-[(2-chloro-6-fluoro-phenyl)methylsulfanyl]-5-[4-(1-piperidylsulfonyl)phenyl]-1,3,4-oxadiazole CAS Name: 2-[(2-chloro-6-fluorophenyl)methylthio]-5-[4-(1-piperidinylsulfonyl)phenyl]-1,3,4-oxadiazole IUPAC Name: 2-[(2-chloro-6-fluorophenyl)methylsulfanyl]-5-(4-piperidin-1-ylsulfonylphenyl)-1,3,4-oxadiazole Traditional Name: 2-[(2-chloro-6-fluoro-benzyl)thio]-5-(4-piperidinosulfonylphenyl)-1,3,4-oxadiazole Formula: C20H19ClFN3O3S2 MolecularWeight: 467.964563

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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=C(C=CC=C4Cl)F

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C3=NN=C(O3)SCC4=C(C=CC=C4Cl)F

InChI

InChI=1S/C20H19ClFN3O3S2/c21-17-5-4-6-18(22)16(17)13-29-20-24-23-19(28-20)14-7-9-15(10-8-14)30(26,27)25-11-2-1-3-12-25/h4-10H,1-3,11-13H2