3-(4-bromophenyl)-5-(1-quinolin-8-ylsulfonylpiperidin-2-yl)-1,2,4-oxadiazole

Systemtic Name: 3-(4-bromophenyl)-5-(1-quinolin-8-ylsulfonylpiperidin-2-yl)-1,2,4-oxadiazole Openeye Name: 3-(4-bromophenyl)-5-[1-(8-quinolylsulfonyl)-2-piperidyl]-1,2,4-oxadiazole CAS Name: 3-(4-bromophenyl)-5-[1-(8-quinolinylsulfonyl)-2-piperidinyl]-1,2,4-oxadiazole IUPAC Name: 3-(4-bromophenyl)-5-(1-quinolin-8-ylsulfonylpiperidin-2-yl)-1,2,4-oxadiazole Traditional Name: 3-(4-bromophenyl)-5-[1-(8-quinolylsulfonyl)-2-piperidyl]-1,2,4-oxadiazole Formula: C22H19BrN4O3S MolecularWeight: 499.38026

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C2=NC(=NO2)C3=CC=C(C=C3)Br)S(=O)(=O)C4=CC=CC5=C4N=CC=C5

Isomeric SMILES

C1CCN(C(C1)C2=NC(=NO2)C3=CC=C(C=C3)Br)S(=O)(=O)C4=CC=CC5=C4N=CC=C5

InChI

InChI=1S/C22H19BrN4O3S/c23-17-11-9-16(10-12-17)21-25-22(30-26-21)18-7-1-2-14-27(18)31(28,29)19-8-3-5-15-6-4-13-24-20(15)19/h3-6,8-13,18H,1-2,7,14H2