4-[[2,3-bis(oxidanyl)phenyl]-oxidanyl-methyl]-2-methyl-piperazine-1-carbodithioate

Systemtic Name: 4-[[2,3-bis(oxidanyl)phenyl]-oxidanyl-methyl]-2-methyl-piperazine-1-carbodithioate Openeye Name: 4-[(2,3-dihydroxyphenyl)-hydroxy-methyl]-2-methyl-piperazine-1-carbodithioate CAS Name: 4-[(2,3-dihydroxyphenyl)-hydroxymethyl]-2-methyl-1-piperazinecarbodithioate IUPAC Name: 4-[(2,3-dihydroxyphenyl)-hydroxymethyl]-2-methylpiperazine-1-carbodithioate Traditional Name: 4-[(2,3-dihydroxyphenyl)-hydroxy-methyl]-2-methyl-piperazine-1-carbodithioate Formula: C13H17N2O3S2- MolecularWeight: 313.41568

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=S)[S-])C(C2=C(C(=CC=C2)O)O)O

Isomeric SMILES

CC1CN(CCN1C(=S)[S-])C(C2=C(C(=CC=C2)O)O)O

InChI

InChI=1S/C13H18N2O3S2/c1-8-7-14(5-6-15(8)13(19)20)12(18)9-3-2-4-10(16)11(9)17/h2-4,8,12,16-18H,5-7H2,1H3,(H,19,20)/p-1