1-[(4-tert-butylphenyl)methyl]-4-(2,3,4,5,6-pentamethylphenyl)sulfonyl-piperazine

Systemtic Name: 1-[(4-tert-butylphenyl)methyl]-4-(2,3,4,5,6-pentamethylphenyl)sulfonyl-piperazine Openeye Name: 1-[(4-tert-butylphenyl)methyl]-4-(2,3,4,5,6-pentamethylphenyl)sulfonyl-piperazine CAS Name: 1-[(4-tert-butylphenyl)methyl]-4-(2,3,4,5,6-pentamethylphenyl)sulfonylpiperazine IUPAC Name: 1-[(4-tert-butylphenyl)methyl]-4-(2,3,4,5,6-pentamethylphenyl)sulfonylpiperazine Traditional Name: 1-(4-tert-butylbenzyl)-4-(2,3,4,5,6-pentamethylphenyl)sulfonyl-piperazine Formula: C26H38N2O2S MolecularWeight: 442.65712

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1C)C)S(=O)(=O)N2CCN(CC2)CC3=CC=C(C=C3)C(C)(C)C)C)C

Isomeric SMILES

CC1=C(C(=C(C(=C1C)C)S(=O)(=O)N2CCN(CC2)CC3=CC=C(C=C3)C(C)(C)C)C)C

InChI

InChI=1S/C26H38N2O2S/c1-18-19(2)21(4)25(22(5)20(18)3)31(29,30)28-15-13-27(14-16-28)17-23-9-11-24(12-10-23)26(6,7)8/h9-12H,13-17H2,1-8H3