1-[(4-bromanyl-2-fluoranyl-phenyl)methyl]-4-pyridin-3-ylsulfonyl-piperazine

Systemtic Name: 1-[(4-bromanyl-2-fluoranyl-phenyl)methyl]-4-pyridin-3-ylsulfonyl-piperazine Openeye Name: 1-[(4-bromo-2-fluoro-phenyl)methyl]-4-(3-pyridylsulfonyl)piperazine CAS Name: 1-[(4-bromo-2-fluorophenyl)methyl]-4-(3-pyridinylsulfonyl)piperazine IUPAC Name: 1-[(4-bromo-2-fluorophenyl)methyl]-4-pyridin-3-ylsulfonylpiperazine Traditional Name: 1-(4-bromo-2-fluoro-benzyl)-4-(3-pyridylsulfonyl)piperazine Formula: C16H17BrFN3O2S MolecularWeight: 414.292483

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=C(C=C(C=C2)Br)F)S(=O)(=O)C3=CN=CC=C3

Isomeric SMILES

C1CN(CCN1CC2=C(C=C(C=C2)Br)F)S(=O)(=O)C3=CN=CC=C3

InChI

InChI=1S/C16H17BrFN3O2S/c17-14-4-3-13(16(18)10-14)12-20-6-8-21(9-7-20)24(22,23)15-2-1-5-19-11-15/h1-5,10-11H,6-9,12H2