6-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-N-ethyl-N-phenyl-pyridin-1-ium-3-sulfonamide

Systemtic Name: 6-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-N-ethyl-N-phenyl-pyridin-1-ium-3-sulfonamide Openeye Name: 6-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-N-ethyl-N-phenyl-pyridin-1-ium-3-sulfonamide CAS Name: 6-[4-(2,4-dimethylphenyl)sulfonyl-1-piperazinyl]-N-ethyl-N-phenyl-3-pyridin-1-iumsulfonamide IUPAC Name: 6-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-N-ethyl-N-phenylpyridin-1-ium-3-sulfonamide Traditional Name: 6-[4-(2,4-dimethylphenyl)sulfonylpiperazino]-N-ethyl-N-phenyl-pyridin-1-ium-3-sulfonamide Formula: C25H31N4O4S2+ MolecularWeight: 515.66804

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)S(=O)(=O)C2=C[NH+]=C(C=C2)N3CCN(CC3)S(=O)(=O)C4=C(C=C(C=C4)C)C

Isomeric SMILES

CCN(C1=CC=CC=C1)S(=O)(=O)C2=C[NH+]=C(C=C2)N3CCN(CC3)S(=O)(=O)C4=C(C=C(C=C4)C)C

InChI

InChI=1S/C25H30N4O4S2/c1-4-29(22-8-6-5-7-9-22)34(30,31)23-11-13-25(26-19-23)27-14-16-28(17-15-27)35(32,33)24-12-10-20(2)18-21(24)3/h5-13,18-19H,4,14-17H2,1-3H3/p+1