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

Systemtic Name: 2-(3-piperidin-1-ylsulfonylphenyl)-5-[(4-pyrazol-1-ylphenyl)methylsulfanyl]-1,3,4-oxadiazole Openeye Name: 2-[3-(1-piperidylsulfonyl)phenyl]-5-[(4-pyrazol-1-ylphenyl)methylsulfanyl]-1,3,4-oxadiazole CAS Name: 2-[3-(1-piperidinylsulfonyl)phenyl]-5-[[4-(1-pyrazolyl)phenyl]methylthio]-1,3,4-oxadiazole IUPAC Name: 2-(3-piperidin-1-ylsulfonylphenyl)-5-[(4-pyrazol-1-ylphenyl)methylsulfanyl]-1,3,4-oxadiazole Traditional Name: 2-(3-piperidinosulfonylphenyl)-5-[(4-pyrazol-1-ylbenzyl)thio]-1,3,4-oxadiazole Formula: C23H23N5O3S2 MolecularWeight: 481.59042

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C3=NN=C(O3)SCC4=CC=C(C=C4)N5C=CC=N5

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C3=NN=C(O3)SCC4=CC=C(C=C4)N5C=CC=N5

InChI

InChI=1S/C23H23N5O3S2/c29-33(30,27-13-2-1-3-14-27)21-7-4-6-19(16-21)22-25-26-23(31-22)32-17-18-8-10-20(11-9-18)28-15-5-12-24-28/h4-12,15-16H,1-3,13-14,17H2