1-[(4-tert-butylphenyl)methyl]-4-(3-fluorophenyl)sulfonyl-piperazine

Systemtic Name: 1-[(4-tert-butylphenyl)methyl]-4-(3-fluorophenyl)sulfonyl-piperazine Openeye Name: 1-[(4-tert-butylphenyl)methyl]-4-(3-fluorophenyl)sulfonyl-piperazine CAS Name: 1-[(4-tert-butylphenyl)methyl]-4-(3-fluorophenyl)sulfonylpiperazine IUPAC Name: 1-[(4-tert-butylphenyl)methyl]-4-(3-fluorophenyl)sulfonylpiperazine Traditional Name: 1-(4-tert-butylbenzyl)-4-(3-fluorophenyl)sulfonyl-piperazine Formula: C21H27FN2O2S MolecularWeight: 390.514683

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CN2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)F

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CN2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)F

InChI

InChI=1S/C21H27FN2O2S/c1-21(2,3)18-9-7-17(8-10-18)16-23-11-13-24(14-12-23)27(25,26)20-6-4-5-19(22)15-20/h4-10,15H,11-14,16H2,1-3H3