2-[[3-[6-(2-methylsulfonylpropan-2-yl)quinolin-8-yl]phenyl]methylsulfanyl]-5-phenyl-1,3,4-oxadiazole

Systemtic Name: 2-[[3-[6-(2-methylsulfonylpropan-2-yl)quinolin-8-yl]phenyl]methylsulfanyl]-5-phenyl-1,3,4-oxadiazole Openeye Name: 2-[[3-[6-(1-methyl-1-methylsulfonyl-ethyl)-8-quinolyl]phenyl]methylsulfanyl]-5-phenyl-1,3,4-oxadiazole CAS Name: 2-[[3-[6-(2-methylsulfonylpropan-2-yl)-8-quinolinyl]phenyl]methylthio]-5-phenyl-1,3,4-oxadiazole IUPAC Name: 2-[[3-[6-(2-methylsulfonylpropan-2-yl)quinolin-8-yl]phenyl]methylsulfanyl]-5-phenyl-1,3,4-oxadiazole Traditional Name: 2-[[3-[6-(1-mesyl-1-methyl-ethyl)-8-quinolyl]benzyl]thio]-5-phenyl-1,3,4-oxadiazole Formula: C28H25N3O3S2 MolecularWeight: 515.6464

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC(=C2C(=C1)C=CC=N2)C3=CC(=CC=C3)CSC4=NN=C(O4)C5=CC=CC=C5)S(=O)(=O)C

Isomeric SMILES

CC(C)(C1=CC(=C2C(=C1)C=CC=N2)C3=CC(=CC=C3)CSC4=NN=C(O4)C5=CC=CC=C5)S(=O)(=O)C

InChI

InChI=1S/C28H25N3O3S2/c1-28(2,36(3,32)33)23-16-22-13-8-14-29-25(22)24(17-23)21-12-7-9-19(15-21)18-35-27-31-30-26(34-27)20-10-5-4-6-11-20/h4-17H,18H2,1-3H3