2-[4-(4-butan-2-ylphenyl)sulfonylpiperazin-1-yl]-1-(2-fluorophenyl)ethanol

Systemtic Name: 2-[4-(4-butan-2-ylphenyl)sulfonylpiperazin-1-yl]-1-(2-fluorophenyl)ethanol Openeye Name: 1-(2-fluorophenyl)-2-[4-(4-sec-butylphenyl)sulfonylpiperazin-1-yl]ethanol CAS Name: 2-[4-(4-butan-2-ylphenyl)sulfonyl-1-piperazinyl]-1-(2-fluorophenyl)ethanol IUPAC Name: 2-[4-(4-butan-2-ylphenyl)sulfonylpiperazin-1-yl]-1-(2-fluorophenyl)ethanol Traditional Name: 1-(2-fluorophenyl)-2-[4-(4-sec-butylphenyl)sulfonylpiperazino]ethanol Formula: C22H29FN2O3S MolecularWeight: 420.540663

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H29FN2O3S/c1-3-17(2)18-8-10-19(11-9-18)29(27,28)25-14-12-24(13-15-25)16-22(26)20-6-4-5-7-21(20)23/h4-11,17,22,26H,3,12-16H2,1-2H3