[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]-(2-methyl-5-methylsulfonyl-phenyl)methanone

Systemtic Name: [4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]-(2-methyl-5-methylsulfonyl-phenyl)methanone Openeye Name: [4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]-(2-methyl-5-methylsulfonyl-phenyl)methanone CAS Name: [4-[bis(4-fluorophenyl)methyl]-1-piperazinyl]-(2-methyl-5-methylsulfonylphenyl)methanone IUPAC Name: [4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]-(2-methyl-5-methylsulfonylphenyl)methanone Traditional Name: [4-[bis(4-fluorophenyl)methyl]piperazino]-(5-mesyl-2-methyl-phenyl)methanone Formula: C26H26F2N2O3S MolecularWeight: 484.558046

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)C)C(=O)N2CCN(CC2)C(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)C)C(=O)N2CCN(CC2)C(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F

InChI

InChI=1S/C26H26F2N2O3S/c1-18-3-12-23(34(2,32)33)17-24(18)26(31)30-15-13-29(14-16-30)25(19-4-8-21(27)9-5-19)20-6-10-22(28)11-7-20/h3-12,17,25H,13-16H2,1-2H3