1-(3-methylphenyl)-4-(4-pentylphenyl)sulfonyl-piperazine

Systemtic Name: 1-(3-methylphenyl)-4-(4-pentylphenyl)sulfonyl-piperazine Openeye Name: 1-(m-tolyl)-4-(4-pentylphenyl)sulfonyl-piperazine CAS Name: 1-(3-methylphenyl)-4-(4-pentylphenyl)sulfonylpiperazine IUPAC Name: 1-(3-methylphenyl)-4-(4-pentylphenyl)sulfonylpiperazine Traditional Name: 1-(4-amylphenyl)sulfonyl-4-(m-tolyl)piperazine Formula: C22H30N2O2S MolecularWeight: 386.5508

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H30N2O2S/c1-3-4-5-8-20-10-12-22(13-11-20)27(25,26)24-16-14-23(15-17-24)21-9-6-7-19(2)18-21/h6-7,9-13,18H,3-5,8,14-17H2,1-2H3