methyl 4-[(3,4,5-trimethoxyphenyl)methyl]piperazine-1-carbodithioate

Systemtic Name: methyl 4-[(3,4,5-trimethoxyphenyl)methyl]piperazine-1-carbodithioate Openeye Name: methyl 4-[(3,4,5-trimethoxyphenyl)methyl]piperazine-1-carbodithioate CAS Name: 4-[(3,4,5-trimethoxyphenyl)methyl]-1-piperazinecarbodithioic acid methyl ester IUPAC Name: methyl 4-[(3,4,5-trimethoxyphenyl)methyl]piperazine-1-carbodithioate Traditional Name: 4-(3,4,5-trimethoxybenzyl)piperazine-1-carbodithioic acid methyl ester Formula: C16H24N2O3S2 MolecularWeight: 356.50336

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CN2CCN(CC2)C(=S)SC

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CN2CCN(CC2)C(=S)SC

InChI

InChI=1S/C16H24N2O3S2/c1-19-13-9-12(10-14(20-2)15(13)21-3)11-17-5-7-18(8-6-17)16(22)23-4/h9-10H,5-8,11H2,1-4H3