propan-2-yl 4-[(3,4,5-trimethoxyphenyl)methyl]piperazine-1-carbodithioate hydrochloride

Systemtic Name: propan-2-yl 4-[(3,4,5-trimethoxyphenyl)methyl]piperazine-1-carbodithioate hydrochloride Openeye Name: isopropyl 4-[(3,4,5-trimethoxyphenyl)methyl]piperazine-1-carbodithioate hydrochloride CAS Name: 4-[(3,4,5-trimethoxyphenyl)methyl]-1-piperazinecarbodithioic acid propan-2-yl ester hydrochloride IUPAC Name: propan-2-yl 4-[(3,4,5-trimethoxyphenyl)methyl]piperazine-1-carbodithioate hydrochloride Traditional Name: 4-(3,4,5-trimethoxybenzyl)piperazine-1-carbodithioic acid isopropyl ester hydrochloride Formula: C18H29ClN2O3S2 MolecularWeight: 421.01746

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC(=S)N1CCN(CC1)CC2=CC(=C(C(=C2)OC)OC)OC.Cl

Isomeric SMILES

CC(C)SC(=S)N1CCN(CC1)CC2=CC(=C(C(=C2)OC)OC)OC.Cl

InChI

InChI=1S/C18H28N2O3S2.ClH/c1-13(2)25-18(24)20-8-6-19(7-9-20)12-14-10-15(21-3)17(23-5)16(11-14)22-4;/h10-11,13H,6-9,12H2,1-5H3;1H