1-[(4-tert-butylphenyl)methyl]-4-(4-chloranyl-2,5-dimethyl-phenyl)sulfonyl-piperazine

Systemtic Name: 1-[(4-tert-butylphenyl)methyl]-4-(4-chloranyl-2,5-dimethyl-phenyl)sulfonyl-piperazine Openeye Name: 1-[(4-tert-butylphenyl)methyl]-4-(4-chloro-2,5-dimethyl-phenyl)sulfonyl-piperazine CAS Name: 1-[(4-tert-butylphenyl)methyl]-4-(4-chloro-2,5-dimethylphenyl)sulfonylpiperazine IUPAC Name: 1-[(4-tert-butylphenyl)methyl]-4-(4-chloro-2,5-dimethylphenyl)sulfonylpiperazine Traditional Name: 1-(4-tert-butylbenzyl)-4-(4-chloro-2,5-dimethyl-phenyl)sulfonyl-piperazine Formula: C23H31ClN2O2S MolecularWeight: 435.02244

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)C)S(=O)(=O)N2CCN(CC2)CC3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CC1=CC(=C(C=C1Cl)C)S(=O)(=O)N2CCN(CC2)CC3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C23H31ClN2O2S/c1-17-15-22(18(2)14-21(17)24)29(27,28)26-12-10-25(11-13-26)16-19-6-8-20(9-7-19)23(3,4)5/h6-9,14-15H,10-13,16H2,1-5H3