1-(2-chlorophenyl)sulfonyl-4-[(4-imidazol-1-ylphenyl)methyl]piperazin-4-ium

Systemtic Name: 1-(2-chlorophenyl)sulfonyl-4-[(4-imidazol-1-ylphenyl)methyl]piperazin-4-ium Openeye Name: 1-(2-chlorophenyl)sulfonyl-4-[(4-imidazol-1-ylphenyl)methyl]piperazin-4-ium CAS Name: 1-(2-chlorophenyl)sulfonyl-4-[[4-(1-imidazolyl)phenyl]methyl]piperazin-4-ium IUPAC Name: 1-(2-chlorophenyl)sulfonyl-4-[(4-imidazol-1-ylphenyl)methyl]piperazin-4-ium Traditional Name: 1-(2-chlorophenyl)sulfonyl-4-(4-imidazol-1-ylbenzyl)piperazin-4-ium Formula: C20H22ClN4O2S+ MolecularWeight: 417.93228

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=C(C=C2)N3C=CN=C3)S(=O)(=O)C4=CC=CC=C4Cl

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=C(C=C2)N3C=CN=C3)S(=O)(=O)C4=CC=CC=C4Cl

InChI

InChI=1S/C20H21ClN4O2S/c21-19-3-1-2-4-20(19)28(26,27)25-13-11-23(12-14-25)15-17-5-7-18(8-6-17)24-10-9-22-16-24/h1-10,16H,11-15H2/p+1