5-(4-fluorophenyl)-2-[[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-1,3-oxazole

Systemtic Name: 5-(4-fluorophenyl)-2-[[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-1,3-oxazole Openeye Name: 5-(4-fluorophenyl)-2-[[4-(4-isopropylphenyl)sulfonylpiperazin-1-ium-1-yl]methyl]oxazole CAS Name: 5-(4-fluorophenyl)-2-[[4-(4-propan-2-ylphenyl)sulfonyl-1-piperazin-1-iumyl]methyl]oxazole IUPAC Name: 5-(4-fluorophenyl)-2-[[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-1,3-oxazole Traditional Name: 5-(4-fluorophenyl)-2-[(4-p-cumenylsulfonylpiperazin-1-ium-1-yl)methyl]oxazole Formula: C23H27FN3O3S+ MolecularWeight: 444.542183

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC3=NC=C(O3)C4=CC=C(C=C4)F

Isomeric SMILES

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC3=NC=C(O3)C4=CC=C(C=C4)F

InChI

InChI=1S/C23H26FN3O3S/c1-17(2)18-5-9-21(10-6-18)31(28,29)27-13-11-26(12-14-27)16-23-25-15-22(30-23)19-3-7-20(24)8-4-19/h3-10,15,17H,11-14,16H2,1-2H3/p+1