2-(2,4-dimethylphenyl)-4-[[4-(phenylsulfonyl)piperazin-1-yl]methyl]-1,3-oxazole

Systemtic Name: 2-(2,4-dimethylphenyl)-4-[[4-(phenylsulfonyl)piperazin-1-yl]methyl]-1,3-oxazole Openeye Name: 4-[[4-(benzenesulfonyl)piperazin-1-yl]methyl]-2-(2,4-dimethylphenyl)oxazole CAS Name: 4-[[4-(benzenesulfonyl)-1-piperazinyl]methyl]-2-(2,4-dimethylphenyl)oxazole IUPAC Name: 4-[[4-(benzenesulfonyl)piperazin-1-yl]methyl]-2-(2,4-dimethylphenyl)-1,3-oxazole Traditional Name: 4-[(4-besylpiperazino)methyl]-2-(2,4-dimethylphenyl)oxazole Formula: C22H25N3O3S MolecularWeight: 411.5172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=NC(=CO2)CN3CCN(CC3)S(=O)(=O)C4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=C(C=C1)C2=NC(=CO2)CN3CCN(CC3)S(=O)(=O)C4=CC=CC=C4)C

InChI

InChI=1S/C22H25N3O3S/c1-17-8-9-21(18(2)14-17)22-23-19(16-28-22)15-24-10-12-25(13-11-24)29(26,27)20-6-4-3-5-7-20/h3-9,14,16H,10-13,15H2,1-2H3