1-(2,5-dimethylphenyl)-4-(4-pentylphenyl)sulfonyl-piperazine

Systemtic Name: 1-(2,5-dimethylphenyl)-4-(4-pentylphenyl)sulfonyl-piperazine Openeye Name: 1-(2,5-dimethylphenyl)-4-(4-pentylphenyl)sulfonyl-piperazine CAS Name: 1-(2,5-dimethylphenyl)-4-(4-pentylphenyl)sulfonylpiperazine IUPAC Name: 1-(2,5-dimethylphenyl)-4-(4-pentylphenyl)sulfonylpiperazine Traditional Name: 1-(4-amylphenyl)sulfonyl-4-(2,5-dimethylphenyl)piperazine Formula: C23H32N2O2S MolecularWeight: 400.57738

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=C(C=CC(=C3)C)C

Isomeric SMILES

CCCCCC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=C(C=CC(=C3)C)C

InChI

InChI=1S/C23H32N2O2S/c1-4-5-6-7-21-10-12-22(13-11-21)28(26,27)25-16-14-24(15-17-25)23-18-19(2)8-9-20(23)3/h8-13,18H,4-7,14-17H2,1-3H3