1-(2-fluoranyl-4-methylsulfonyl-phenyl)-4-(phenylmethyl)piperazine

Systemtic Name: 1-(2-fluoranyl-4-methylsulfonyl-phenyl)-4-(phenylmethyl)piperazine Openeye Name: 1-benzyl-4-(2-fluoro-4-methylsulfonyl-phenyl)piperazine CAS Name: 1-(2-fluoro-4-methylsulfonylphenyl)-4-(phenylmethyl)piperazine IUPAC Name: 1-benzyl-4-(2-fluoro-4-methylsulfonylphenyl)piperazine Traditional Name: 1-benzyl-4-(2-fluoro-4-mesyl-phenyl)piperazine Formula: C18H21FN2O2S MolecularWeight: 348.434943

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21FN2O2S/c1-24(22,23)16-7-8-18(17(19)13-16)21-11-9-20(10-12-21)14-15-5-3-2-4-6-15/h2-8,13H,9-12,14H2,1H3