1-[5-(4-methylpiperazin-4-ium-1-yl)sulfonylpyridin-1-ium-2-yl]-4-[(E)-2-phenylethenyl]sulfonyl-piperazine

Systemtic Name: 1-[5-(4-methylpiperazin-4-ium-1-yl)sulfonylpyridin-1-ium-2-yl]-4-[(E)-2-phenylethenyl]sulfonyl-piperazine Openeye Name: 1-[5-(4-methylpiperazin-4-ium-1-yl)sulfonylpyridin-1-ium-2-yl]-4-[(E)-styryl]sulfonyl-piperazine CAS Name: 1-[5-[(4-methyl-1-piperazin-4-iumyl)sulfonyl]-2-pyridin-1-iumyl]-4-[(E)-2-phenylethenyl]sulfonylpiperazine IUPAC Name: 1-[5-(4-methylpiperazin-4-ium-1-yl)sulfonylpyridin-1-ium-2-yl]-4-[(E)-2-phenylethenyl]sulfonylpiperazine Traditional Name: 1-[5-(4-methylpiperazin-4-ium-1-yl)sulfonylpyridin-1-ium-2-yl]-4-[(E)-styryl]sulfonyl-piperazine Formula: C22H31N5O4S2+2 MolecularWeight: 493.64264

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)S(=O)(=O)C2=C[NH+]=C(C=C2)N3CCN(CC3)S(=O)(=O)C=CC4=CC=CC=C4

Isomeric SMILES

C[NH+]1CCN(CC1)S(=O)(=O)C2=C[NH+]=C(C=C2)N3CCN(CC3)S(=O)(=O)/C=C/C4=CC=CC=C4

InChI

InChI=1S/C22H29N5O4S2/c1-24-10-14-27(15-11-24)33(30,31)21-7-8-22(23-19-21)25-12-16-26(17-13-25)32(28,29)18-9-20-5-3-2-4-6-20/h2-9,18-19H,10-17H2,1H3/p+2/b18-9+