2-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]-5-(pyridin-3-ylmethylsulfanyl)-1,3,4-oxadiazole

Systemtic Name: 2-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]-5-(pyridin-3-ylmethylsulfanyl)-1,3,4-oxadiazole Openeye Name: 2-[4-[(4-methyl-1-piperidyl)sulfonyl]phenyl]-5-(3-pyridylmethylsulfanyl)-1,3,4-oxadiazole CAS Name: 2-[4-[(4-methyl-1-piperidinyl)sulfonyl]phenyl]-5-(3-pyridinylmethylthio)-1,3,4-oxadiazole IUPAC Name: 2-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]-5-(pyridin-3-ylmethylsulfanyl)-1,3,4-oxadiazole Traditional Name: 2-[4-(4-methylpiperidino)sulfonylphenyl]-5-(3-pyridylmethylthio)-1,3,4-oxadiazole Formula: C20H22N4O3S2 MolecularWeight: 430.54368

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C3=NN=C(O3)SCC4=CN=CC=C4

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C3=NN=C(O3)SCC4=CN=CC=C4

InChI

InChI=1S/C20H22N4O3S2/c1-15-8-11-24(12-9-15)29(25,26)18-6-4-17(5-7-18)19-22-23-20(27-19)28-14-16-3-2-10-21-13-16/h2-7,10,13,15H,8-9,11-12,14H2,1H3