methyl 4-[(3,5-dimethoxy-4-oxidanyl-phenyl)methyl]piperazine-1-carbodithioate

Systemtic Name: methyl 4-[(3,5-dimethoxy-4-oxidanyl-phenyl)methyl]piperazine-1-carbodithioate Openeye Name: methyl 4-[(4-hydroxy-3,5-dimethoxy-phenyl)methyl]piperazine-1-carbodithioate CAS Name: 4-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]-1-piperazinecarbodithioic acid methyl ester IUPAC Name: methyl 4-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]piperazine-1-carbodithioate Traditional Name: 4-(4-hydroxy-3,5-dimethoxy-benzyl)piperazine-1-carbodithioic acid methyl ester Formula: C15H22N2O3S2 MolecularWeight: 342.47678

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1O)OC)CN2CCN(CC2)C(=S)SC

Isomeric SMILES

COC1=CC(=CC(=C1O)OC)CN2CCN(CC2)C(=S)SC

InChI

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