1-(2-fluorophenyl)-4-[4-(2-methylbutan-2-yl)phenyl]sulfonyl-piperazine

Systemtic Name: 1-(2-fluorophenyl)-4-[4-(2-methylbutan-2-yl)phenyl]sulfonyl-piperazine Openeye Name: 1-[4-(1,1-dimethylpropyl)phenyl]sulfonyl-4-(2-fluorophenyl)piperazine CAS Name: 1-(2-fluorophenyl)-4-[4-(2-methylbutan-2-yl)phenyl]sulfonylpiperazine IUPAC Name: 1-(2-fluorophenyl)-4-[4-(2-methylbutan-2-yl)phenyl]sulfonylpiperazine Traditional Name: 1-(4-tert-amylphenyl)sulfonyl-4-(2-fluorophenyl)piperazine Formula: C21H27FN2O2S MolecularWeight: 390.514683

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27FN2O2S/c1-4-21(2,3)17-9-11-18(12-10-17)27(25,26)24-15-13-23(14-16-24)20-8-6-5-7-19(20)22/h5-12H,4,13-16H2,1-3H3