methyl 4-[(2,4-dimethoxy-6-oxidanyl-phenyl)methyl]piperazine-1-carbodithioate hydrochloride

Systemtic Name: methyl 4-[(2,4-dimethoxy-6-oxidanyl-phenyl)methyl]piperazine-1-carbodithioate hydrochloride Openeye Name: methyl 4-[(2-hydroxy-4,6-dimethoxy-phenyl)methyl]piperazine-1-carbodithioate hydrochloride CAS Name: 4-[(2-hydroxy-4,6-dimethoxyphenyl)methyl]-1-piperazinecarbodithioic acid methyl ester hydrochloride IUPAC Name: methyl 4-[(2-hydroxy-4,6-dimethoxyphenyl)methyl]piperazine-1-carbodithioate hydrochloride Traditional Name: 4-(2-hydroxy-4,6-dimethoxy-benzyl)piperazine-1-carbodithioic acid methyl ester hydrochloride Formula: C15H23ClN2O3S2 MolecularWeight: 378.93772

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C(=C1)OC)CN2CCN(CC2)C(=S)SC)O.Cl

Isomeric SMILES

COC1=CC(=C(C(=C1)OC)CN2CCN(CC2)C(=S)SC)O.Cl

InChI

InChI=1S/C15H22N2O3S2.ClH/c1-19-11-8-13(18)12(14(9-11)20-2)10-16-4-6-17(7-5-16)15(21)22-3;/h8-9,18H,4-7,10H2,1-3H3;1H