methyl 4-[[2,5-bis(oxidanyl)phenyl]methyl]piperazine-1-carbodithioate

Systemtic Name: methyl 4-[[2,5-bis(oxidanyl)phenyl]methyl]piperazine-1-carbodithioate Openeye Name: methyl 4-[(2,5-dihydroxyphenyl)methyl]piperazine-1-carbodithioate CAS Name: 4-[(2,5-dihydroxyphenyl)methyl]-1-piperazinecarbodithioic acid methyl ester IUPAC Name: methyl 4-[(2,5-dihydroxyphenyl)methyl]piperazine-1-carbodithioate Traditional Name: 4-(2,5-dihydroxybenzyl)piperazine-1-carbodithioic acid methyl ester Formula: C13H18N2O2S2 MolecularWeight: 298.42422

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=S)N1CCN(CC1)CC2=C(C=CC(=C2)O)O

Isomeric SMILES

CSC(=S)N1CCN(CC1)CC2=C(C=CC(=C2)O)O

InChI

InChI=1S/C13H18N2O2S2/c1-19-13(18)15-6-4-14(5-7-15)9-10-8-11(16)2-3-12(10)17/h2-3,8,16-17H,4-7,9H2,1H3