1-[4-(2-fluorophenyl)sulfonylpiperazin-1-yl]-4-(4-methylphenyl)butane-1,4-dione

Systemtic Name: 1-[4-(2-fluorophenyl)sulfonylpiperazin-1-yl]-4-(4-methylphenyl)butane-1,4-dione Openeye Name: 1-[4-(2-fluorophenyl)sulfonylpiperazin-1-yl]-4-(p-tolyl)butane-1,4-dione CAS Name: 1-[4-(2-fluorophenyl)sulfonyl-1-piperazinyl]-4-(4-methylphenyl)butane-1,4-dione IUPAC Name: 1-[4-(2-fluorophenyl)sulfonylpiperazin-1-yl]-4-(4-methylphenyl)butane-1,4-dione Traditional Name: 1-[4-(2-fluorophenyl)sulfonylpiperazino]-4-(p-tolyl)butane-1,4-dione Formula: C21H23FN2O4S MolecularWeight: 418.481723

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)CCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3F

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)CCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3F

InChI

InChI=1S/C21H23FN2O4S/c1-16-6-8-17(9-7-16)19(25)10-11-21(26)23-12-14-24(15-13-23)29(27,28)20-5-3-2-4-18(20)22/h2-9H,10-15H2,1H3