1-[3-[4-[(4-bromanyl-2-fluoranyl-phenyl)methyl]piperazin-1-yl]sulfonylphenyl]ethanone

Systemtic Name: 1-[3-[4-[(4-bromanyl-2-fluoranyl-phenyl)methyl]piperazin-1-yl]sulfonylphenyl]ethanone Openeye Name: 1-[3-[4-[(4-bromo-2-fluoro-phenyl)methyl]piperazin-1-yl]sulfonylphenyl]ethanone CAS Name: 1-[3-[[4-[(4-bromo-2-fluorophenyl)methyl]-1-piperazinyl]sulfonyl]phenyl]ethanone IUPAC Name: 1-[3-[4-[(4-bromo-2-fluorophenyl)methyl]piperazin-1-yl]sulfonylphenyl]ethanone Traditional Name: 1-[3-[4-(4-bromo-2-fluoro-benzyl)piperazino]sulfonylphenyl]ethanone Formula: C19H20BrFN2O3S MolecularWeight: 455.341103

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCN(CC2)CC3=C(C=C(C=C3)Br)F

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCN(CC2)CC3=C(C=C(C=C3)Br)F

InChI

InChI=1S/C19H20BrFN2O3S/c1-14(24)15-3-2-4-18(11-15)27(25,26)23-9-7-22(8-10-23)13-16-5-6-17(20)12-19(16)21/h2-6,11-12H,7-10,13H2,1H3