3-(4-methylphenyl)-5-[2-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonylphenyl]-1,2,4-oxadiazole

Systemtic Name: 3-(4-methylphenyl)-5-[2-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonylphenyl]-1,2,4-oxadiazole Openeye Name: 3-(p-tolyl)-5-[2-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonylphenyl]-1,2,4-oxadiazole CAS Name: 3-(4-methylphenyl)-5-[2-[[4-(2-pyrimidinyl)-1-piperazinyl]sulfonyl]phenyl]-1,2,4-oxadiazole IUPAC Name: 3-(4-methylphenyl)-5-[2-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonylphenyl]-1,2,4-oxadiazole Traditional Name: 3-(p-tolyl)-5-[2-[4-(2-pyrimidyl)piperazino]sulfonylphenyl]-1,2,4-oxadiazole Formula: C23H22N6O3S MolecularWeight: 462.52418

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NOC(=N2)C3=CC=CC=C3S(=O)(=O)N4CCN(CC4)C5=NC=CC=N5

Isomeric SMILES

CC1=CC=C(C=C1)C2=NOC(=N2)C3=CC=CC=C3S(=O)(=O)N4CCN(CC4)C5=NC=CC=N5

InChI

InChI=1S/C23H22N6O3S/c1-17-7-9-18(10-8-17)21-26-22(32-27-21)19-5-2-3-6-20(19)33(30,31)29-15-13-28(14-16-29)23-24-11-4-12-25-23/h2-12H,13-16H2,1H3