N-ethyl-N-phenyl-6-(4-phenylpiperazin-1-yl)pyridin-1-ium-3-sulfonamide

Systemtic Name: N-ethyl-N-phenyl-6-(4-phenylpiperazin-1-yl)pyridin-1-ium-3-sulfonamide Openeye Name: N-ethyl-N-phenyl-6-(4-phenylpiperazin-1-yl)pyridin-1-ium-3-sulfonamide CAS Name: N-ethyl-N-phenyl-6-(4-phenyl-1-piperazinyl)-3-pyridin-1-iumsulfonamide IUPAC Name: N-ethyl-N-phenyl-6-(4-phenylpiperazin-1-yl)pyridin-1-ium-3-sulfonamide Traditional Name: N-ethyl-N-phenyl-6-(4-phenylpiperazino)pyridin-1-ium-3-sulfonamide Formula: C23H27N4O2S+ MolecularWeight: 423.55108

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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)C4=CC=CC=C4

Isomeric SMILES

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

InChI

InChI=1S/C23H26N4O2S/c1-2-27(21-11-7-4-8-12-21)30(28,29)22-13-14-23(24-19-22)26-17-15-25(16-18-26)20-9-5-3-6-10-20/h3-14,19H,2,15-18H2,1H3/p+1