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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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