2-(phenylmethyl)-5-(1-quinolin-8-ylsulfonylpiperidin-3-yl)-1,3,4-thiadiazole

Systemtic Name: 2-(phenylmethyl)-5-(1-quinolin-8-ylsulfonylpiperidin-3-yl)-1,3,4-thiadiazole Openeye Name: 2-benzyl-5-[1-(8-quinolylsulfonyl)-3-piperidyl]-1,3,4-thiadiazole CAS Name: 2-(phenylmethyl)-5-[1-(8-quinolinylsulfonyl)-3-piperidinyl]-1,3,4-thiadiazole IUPAC Name: 2-benzyl-5-(1-quinolin-8-ylsulfonylpiperidin-3-yl)-1,3,4-thiadiazole Traditional Name: 2-benzyl-5-[1-(8-quinolylsulfonyl)-3-piperidyl]-1,3,4-thiadiazole Formula: C23H22N4O2S2 MolecularWeight: 450.57638

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=CC3=C2N=CC=C3)C4=NN=C(S4)CC5=CC=CC=C5

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)C2=CC=CC3=C2N=CC=C3)C4=NN=C(S4)CC5=CC=CC=C5

InChI

InChI=1S/C23H22N4O2S2/c28-31(29,20-12-4-9-18-10-5-13-24-22(18)20)27-14-6-11-19(16-27)23-26-25-21(30-23)15-17-7-2-1-3-8-17/h1-5,7-10,12-13,19H,6,11,14-16H2