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

Systemtic Name: 2-(2-methoxyphenyl)-5-[1-(phenylsulfonyl)piperidin-4-yl]-1,3,4-thiadiazole Openeye Name: 2-[1-(benzenesulfonyl)-4-piperidyl]-5-(2-methoxyphenyl)-1,3,4-thiadiazole CAS Name: 2-[1-(benzenesulfonyl)-4-piperidinyl]-5-(2-methoxyphenyl)-1,3,4-thiadiazole IUPAC Name: 2-[1-(benzenesulfonyl)piperidin-4-yl]-5-(2-methoxyphenyl)-1,3,4-thiadiazole Traditional Name: 2-(1-besyl-4-piperidyl)-5-(2-methoxyphenyl)-1,3,4-thiadiazole Formula: C20H21N3O3S2 MolecularWeight: 415.52904

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=NN=C(S2)C3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC=C1C2=NN=C(S2)C3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C20H21N3O3S2/c1-26-18-10-6-5-9-17(18)20-22-21-19(27-20)15-11-13-23(14-12-15)28(24,25)16-7-3-2-4-8-16/h2-10,15H,11-14H2,1H3