3-[[4-[1,1-bis(oxidanylidene)thiolan-3-yl]piperazin-1-yl]methyl]-5-tert-butyl-benzene-1,2-diol

Systemtic Name: 3-[[4-[1,1-bis(oxidanylidene)thiolan-3-yl]piperazin-1-yl]methyl]-5-tert-butyl-benzene-1,2-diol Openeye Name: 5-tert-butyl-3-[[4-(1,1-dioxothiolan-3-yl)piperazin-1-yl]methyl]benzene-1,2-diol CAS Name: 5-tert-butyl-3-[[4-(1,1-dioxo-3-thiolanyl)-1-piperazinyl]methyl]benzene-1,2-diol IUPAC Name: 5-tert-butyl-3-[[4-(1,1-dioxothiolan-3-yl)piperazin-1-yl]methyl]benzene-1,2-diol Traditional Name: 5-tert-butyl-3-[[4-(1,1-diketothiolan-3-yl)piperazino]methyl]pyrocatechol Formula: C19H30N2O4S MolecularWeight: 382.5175

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C(=C1)O)O)CN2CCN(CC2)C3CCS(=O)(=O)C3

Isomeric SMILES

CC(C)(C)C1=CC(=C(C(=C1)O)O)CN2CCN(CC2)C3CCS(=O)(=O)C3

InChI

InChI=1S/C19H30N2O4S/c1-19(2,3)15-10-14(18(23)17(22)11-15)12-20-5-7-21(8-6-20)16-4-9-26(24,25)13-16/h10-11,16,22-23H,4-9,12-13H2,1-3H3