2-[[2,5-dimethyl-4-[(1-oxidanylpyridin-1-ium-2-yl)sulfanylmethyl]phenyl]methylsulfanyl]-1-oxidanyl-pyridin-1-ium

Systemtic Name: 2-[[2,5-dimethyl-4-[(1-oxidanylpyridin-1-ium-2-yl)sulfanylmethyl]phenyl]methylsulfanyl]-1-oxidanyl-pyridin-1-ium Openeye Name: 1-hydroxy-2-[[4-[(1-hydroxypyridin-1-ium-2-yl)sulfanylmethyl]-2,5-dimethyl-phenyl]methylsulfanyl]pyridin-1-ium CAS Name: 1-hydroxy-2-[[4-[[(1-hydroxy-2-pyridin-1-iumyl)thio]methyl]-2,5-dimethylphenyl]methylthio]pyridin-1-ium IUPAC Name: 1-hydroxy-2-[[4-[(1-hydroxypyridin-1-ium-2-yl)sulfanylmethyl]-2,5-dimethylphenyl]methylsulfanyl]pyridin-1-ium Traditional Name: 1-hydroxy-2-[[4-[[(1-hydroxypyridin-1-ium-2-yl)thio]methyl]-2,5-dimethyl-benzyl]thio]pyridin-1-ium Formula: C20H22N2O2S2+2 MolecularWeight: 386.53088

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1CSC2=CC=CC=[N+]2O)C)CSC3=CC=CC=[N+]3O

Isomeric SMILES

CC1=CC(=C(C=C1CSC2=CC=CC=[N+]2O)C)CSC3=CC=CC=[N+]3O

InChI

InChI=1S/C20H22N2O2S2/c1-15-11-18(14-26-20-8-4-6-10-22(20)24)16(2)12-17(15)13-25-19-7-3-5-9-21(19)23/h3-12,23-24H,13-14H2,1-2H3/q+2