5-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]-3-(phenylmethyl)-1,2,4-oxadiazole

Systemtic Name: 5-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]-3-(phenylmethyl)-1,2,4-oxadiazole Openeye Name: 3-benzyl-5-[[4-(p-tolylsulfonyl)piperazin-1-yl]methyl]-1,2,4-oxadiazole CAS Name: 5-[[4-(4-methylphenyl)sulfonyl-1-piperazinyl]methyl]-3-(phenylmethyl)-1,2,4-oxadiazole IUPAC Name: 3-benzyl-5-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]-1,2,4-oxadiazole Traditional Name: 3-benzyl-5-[(4-tosylpiperazino)methyl]-1,2,4-oxadiazole Formula: C21H24N4O3S MolecularWeight: 412.50526

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=NC(=NO3)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=NC(=NO3)CC4=CC=CC=C4

InChI

InChI=1S/C21H24N4O3S/c1-17-7-9-19(10-8-17)29(26,27)25-13-11-24(12-14-25)16-21-22-20(23-28-21)15-18-5-3-2-4-6-18/h2-10H,11-16H2,1H3