[4-(3-fluoranyl-4-methylsulfonyl-phenyl)piperazin-1-yl]-[2-(2-methylpropoxy)-5-methylsulfonyl-phenyl]methanone

Systemtic Name: [4-(3-fluoranyl-4-methylsulfonyl-phenyl)piperazin-1-yl]-[2-(2-methylpropoxy)-5-methylsulfonyl-phenyl]methanone Openeye Name: [4-(3-fluoro-4-methylsulfonyl-phenyl)piperazin-1-yl]-(2-isobutoxy-5-methylsulfonyl-phenyl)methanone CAS Name: [4-(3-fluoro-4-methylsulfonylphenyl)-1-piperazinyl]-[2-(2-methylpropoxy)-5-methylsulfonylphenyl]methanone IUPAC Name: [4-(3-fluoro-4-methylsulfonylphenyl)piperazin-1-yl]-[2-(2-methylpropoxy)-5-methylsulfonylphenyl]methanone Traditional Name: [4-(3-fluoro-4-mesyl-phenyl)piperazino]-(2-isobutoxy-5-mesyl-phenyl)methanone Formula: C23H29FN2O6S2 MolecularWeight: 512.614563

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=C(C=C1)S(=O)(=O)C)C(=O)N2CCN(CC2)C3=CC(=C(C=C3)S(=O)(=O)C)F

Isomeric SMILES

CC(C)COC1=C(C=C(C=C1)S(=O)(=O)C)C(=O)N2CCN(CC2)C3=CC(=C(C=C3)S(=O)(=O)C)F

InChI

InChI=1S/C23H29FN2O6S2/c1-16(2)15-32-21-7-6-18(33(3,28)29)14-19(21)23(27)26-11-9-25(10-12-26)17-5-8-22(20(24)13-17)34(4,30)31/h5-8,13-14,16H,9-12,15H2,1-4H3