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

Systemtic Name: 3-(3-methylphenyl)-5-(1-quinolin-8-ylsulfonylpiperidin-3-yl)-1,2,4-oxadiazole Openeye Name: 3-(m-tolyl)-5-[1-(8-quinolylsulfonyl)-3-piperidyl]-1,2,4-oxadiazole CAS Name: 3-(3-methylphenyl)-5-[1-(8-quinolinylsulfonyl)-3-piperidinyl]-1,2,4-oxadiazole IUPAC Name: 3-(3-methylphenyl)-5-(1-quinolin-8-ylsulfonylpiperidin-3-yl)-1,2,4-oxadiazole Traditional Name: 3-(m-tolyl)-5-[1-(8-quinolylsulfonyl)-3-piperidyl]-1,2,4-oxadiazole Formula: C23H22N4O3S MolecularWeight: 434.51078

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NOC(=N2)C3CCCN(C3)S(=O)(=O)C4=CC=CC5=C4N=CC=C5

Isomeric SMILES

CC1=CC=CC(=C1)C2=NOC(=N2)C3CCCN(C3)S(=O)(=O)C4=CC=CC5=C4N=CC=C5

InChI

InChI=1S/C23H22N4O3S/c1-16-6-2-8-18(14-16)22-25-23(30-26-22)19-10-5-13-27(15-19)31(28,29)20-11-3-7-17-9-4-12-24-21(17)20/h2-4,6-9,11-12,14,19H,5,10,13,15H2,1H3