2-(2-fluorophenyl)-5-[1-(phenylsulfonyl)piperidin-3-yl]-1,3,4-thiadiazole

Systemtic Name: 2-(2-fluorophenyl)-5-[1-(phenylsulfonyl)piperidin-3-yl]-1,3,4-thiadiazole Openeye Name: 2-[1-(benzenesulfonyl)-3-piperidyl]-5-(2-fluorophenyl)-1,3,4-thiadiazole CAS Name: 2-[1-(benzenesulfonyl)-3-piperidinyl]-5-(2-fluorophenyl)-1,3,4-thiadiazole IUPAC Name: 2-[1-(benzenesulfonyl)piperidin-3-yl]-5-(2-fluorophenyl)-1,3,4-thiadiazole Traditional Name: 2-(1-besyl-3-piperidyl)-5-(2-fluorophenyl)-1,3,4-thiadiazole Formula: C19H18FN3O2S2 MolecularWeight: 403.493523

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=CC=C2)C3=NN=C(S3)C4=CC=CC=C4F

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)C2=CC=CC=C2)C3=NN=C(S3)C4=CC=CC=C4F

InChI

InChI=1S/C19H18FN3O2S2/c20-17-11-5-4-10-16(17)19-22-21-18(26-19)14-7-6-12-23(13-14)27(24,25)15-8-2-1-3-9-15/h1-5,8-11,14H,6-7,12-13H2