4-[4-[(4,5-dimethoxy-2-methyl-phenyl)methyl]piperazin-1-yl]-1,1-bis(oxidanylidene)thiolan-3-ol

Systemtic Name: 4-[4-[(4,5-dimethoxy-2-methyl-phenyl)methyl]piperazin-1-yl]-1,1-bis(oxidanylidene)thiolan-3-ol Openeye Name: 4-[4-[(4,5-dimethoxy-2-methyl-phenyl)methyl]piperazin-1-yl]-1,1-dioxo-thiolan-3-ol CAS Name: 4-[4-[(4,5-dimethoxy-2-methylphenyl)methyl]-1-piperazinyl]-1,1-dioxo-3-thiolanol IUPAC Name: 4-[4-[(4,5-dimethoxy-2-methylphenyl)methyl]piperazin-1-yl]-1,1-dioxothiolan-3-ol Traditional Name: 4-[4-(4,5-dimethoxy-2-methyl-benzyl)piperazino]-1,1-diketo-thiolan-3-ol Formula: C18H28N2O5S MolecularWeight: 384.49032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1CN2CCN(CC2)C3CS(=O)(=O)CC3O)OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1CN2CCN(CC2)C3CS(=O)(=O)CC3O)OC)OC

InChI

InChI=1S/C18H28N2O5S/c1-13-8-17(24-2)18(25-3)9-14(13)10-19-4-6-20(7-5-19)15-11-26(22,23)12-16(15)21/h8-9,15-16,21H,4-7,10-12H2,1-3H3