1-[3-(4-chlorophenyl)sulfonyl-4-methyl-6-phenyl-pyridin-2-yl]-4-methyl-piperazin-4-ium

Systemtic Name: 1-[3-(4-chlorophenyl)sulfonyl-4-methyl-6-phenyl-pyridin-2-yl]-4-methyl-piperazin-4-ium Openeye Name: 1-[3-(4-chlorophenyl)sulfonyl-4-methyl-6-phenyl-2-pyridyl]-4-methyl-piperazin-4-ium CAS Name: 1-[3-(4-chlorophenyl)sulfonyl-4-methyl-6-phenyl-2-pyridinyl]-4-methylpiperazin-4-ium IUPAC Name: 1-[3-(4-chlorophenyl)sulfonyl-4-methyl-6-phenylpyridin-2-yl]-4-methylpiperazin-4-ium Traditional Name: 1-[3-(4-chlorophenyl)sulfonyl-4-methyl-6-phenyl-2-pyridyl]-4-methyl-piperazin-4-ium Formula: C23H25ClN3O2S+ MolecularWeight: 442.9815

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C1S(=O)(=O)C2=CC=C(C=C2)Cl)N3CC[NH+](CC3)C)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=NC(=C1S(=O)(=O)C2=CC=C(C=C2)Cl)N3CC[NH+](CC3)C)C4=CC=CC=C4

InChI

InChI=1S/C23H24ClN3O2S/c1-17-16-21(18-6-4-3-5-7-18)25-23(27-14-12-26(2)13-15-27)22(17)30(28,29)20-10-8-19(24)9-11-20/h3-11,16H,12-15H2,1-2H3/p+1