1-[[2,6-bis(chloranyl)phenyl]methyl]-4-(4-butan-2-ylphenyl)sulfonyl-piperazine

Systemtic Name: 1-[[2,6-bis(chloranyl)phenyl]methyl]-4-(4-butan-2-ylphenyl)sulfonyl-piperazine Openeye Name: 1-[(2,6-dichlorophenyl)methyl]-4-(4-sec-butylphenyl)sulfonyl-piperazine CAS Name: 1-(4-butan-2-ylphenyl)sulfonyl-4-[(2,6-dichlorophenyl)methyl]piperazine IUPAC Name: 1-(4-butan-2-ylphenyl)sulfonyl-4-[(2,6-dichlorophenyl)methyl]piperazine Traditional Name: 1-(2,6-dichlorobenzyl)-4-(4-sec-butylphenyl)sulfonyl-piperazine Formula: C21H26Cl2N2O2S MolecularWeight: 441.41434

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=C(C=CC=C3Cl)Cl

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=C(C=CC=C3Cl)Cl

InChI

InChI=1S/C21H26Cl2N2O2S/c1-3-16(2)17-7-9-18(10-8-17)28(26,27)25-13-11-24(12-14-25)15-19-20(22)5-4-6-21(19)23/h4-10,16H,3,11-15H2,1-2H3