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

Systemtic Name: 2-methylsulfanyl-5-[[3-[6-(2-methylsulfonylpropan-2-yl)quinolin-8-yl]phenyl]methylsulfanyl]-1,3,4-thiadiazole Openeye Name: 2-[[3-[6-(1-methyl-1-methylsulfonyl-ethyl)-8-quinolyl]phenyl]methylsulfanyl]-5-methylsulfanyl-1,3,4-thiadiazole CAS Name: 2-[[3-[6-(2-methylsulfonylpropan-2-yl)-8-quinolinyl]phenyl]methylthio]-5-(methylthio)-1,3,4-thiadiazole IUPAC Name: 2-methylsulfanyl-5-[[3-[6-(2-methylsulfonylpropan-2-yl)quinolin-8-yl]phenyl]methylsulfanyl]-1,3,4-thiadiazole Traditional Name: 2-[[3-[6-(1-mesyl-1-methyl-ethyl)-8-quinolyl]benzyl]thio]-5-(methylthio)-1,3,4-thiadiazole Formula: C23H23N3O2S4 MolecularWeight: 501.70762

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(S4)SC)S(=O)(=O)C

Isomeric SMILES

CC(C)(C1=CC(=C2C(=C1)C=CC=N2)C3=CC(=CC=C3)CSC4=NN=C(S4)SC)S(=O)(=O)C

InChI

InChI=1S/C23H23N3O2S4/c1-23(2,32(4,27)28)18-12-17-9-6-10-24-20(17)19(13-18)16-8-5-7-15(11-16)14-30-22-26-25-21(29-3)31-22/h5-13H,14H2,1-4H3