1-methyl-4-[6-(1-methylimidazol-2-yl)sulfanylpyridin-3-yl]sulfonyl-piperazin-1-ium

Systemtic Name: 1-methyl-4-[6-(1-methylimidazol-2-yl)sulfanylpyridin-3-yl]sulfonyl-piperazin-1-ium Openeye Name: 1-methyl-4-[[6-(1-methylimidazol-2-yl)sulfanyl-3-pyridyl]sulfonyl]piperazin-1-ium CAS Name: 1-methyl-4-[[6-[(1-methyl-2-imidazolyl)thio]-3-pyridinyl]sulfonyl]piperazin-1-ium IUPAC Name: 1-methyl-4-[6-(1-methylimidazol-2-yl)sulfanylpyridin-3-yl]sulfonylpiperazin-1-ium Traditional Name: 1-methyl-4-[[6-[(1-methylimidazol-2-yl)thio]-3-pyridyl]sulfonyl]piperazin-1-ium Formula: C14H20N5O2S2+ MolecularWeight: 354.4709

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)S(=O)(=O)C2=CN=C(C=C2)SC3=NC=CN3C

Isomeric SMILES

C[NH+]1CCN(CC1)S(=O)(=O)C2=CN=C(C=C2)SC3=NC=CN3C

InChI

InChI=1S/C14H19N5O2S2/c1-17-7-9-19(10-8-17)23(20,21)12-3-4-13(16-11-12)22-14-15-5-6-18(14)2/h3-6,11H,7-10H2,1-2H3/p+1