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

Systemtic Name: 1-[(4-tert-butylphenyl)methyl]-4-(2,3,5,6-tetramethylphenyl)sulfonyl-piperazine Openeye Name: 1-[(4-tert-butylphenyl)methyl]-4-(2,3,5,6-tetramethylphenyl)sulfonyl-piperazine CAS Name: 1-[(4-tert-butylphenyl)methyl]-4-(2,3,5,6-tetramethylphenyl)sulfonylpiperazine IUPAC Name: 1-[(4-tert-butylphenyl)methyl]-4-(2,3,5,6-tetramethylphenyl)sulfonylpiperazine Traditional Name: 1-(4-tert-butylbenzyl)-4-(2,3,5,6-tetramethylphenyl)sulfonyl-piperazine Formula: C25H36N2O2S MolecularWeight: 428.63054

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H36N2O2S/c1-18-16-19(2)21(4)24(20(18)3)30(28,29)27-14-12-26(13-15-27)17-22-8-10-23(11-9-22)25(5,6)7/h8-11,16H,12-15,17H2,1-7H3