1-[(3-bromophenyl)methyl]-4-(5-fluoranyl-2-methyl-phenyl)sulfonyl-piperazine

Systemtic Name: 1-[(3-bromophenyl)methyl]-4-(5-fluoranyl-2-methyl-phenyl)sulfonyl-piperazine Openeye Name: 1-[(3-bromophenyl)methyl]-4-(5-fluoro-2-methyl-phenyl)sulfonyl-piperazine CAS Name: 1-[(3-bromophenyl)methyl]-4-(5-fluoro-2-methylphenyl)sulfonylpiperazine IUPAC Name: 1-[(3-bromophenyl)methyl]-4-(5-fluoro-2-methylphenyl)sulfonylpiperazine Traditional Name: 1-(3-bromobenzyl)-4-(5-fluoro-2-methyl-phenyl)sulfonyl-piperazine Formula: C18H20BrFN2O2S MolecularWeight: 427.331003

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)F)S(=O)(=O)N2CCN(CC2)CC3=CC(=CC=C3)Br

Isomeric SMILES

CC1=C(C=C(C=C1)F)S(=O)(=O)N2CCN(CC2)CC3=CC(=CC=C3)Br

InChI

InChI=1S/C18H20BrFN2O2S/c1-14-5-6-17(20)12-18(14)25(23,24)22-9-7-21(8-10-22)13-15-3-2-4-16(19)11-15/h2-6,11-12H,7-10,13H2,1H3