3,5-ditert-butyl-5-(4-hydroxyphenyl)-2-methylidene-3-(4-methylpiperazin-1-yl)-1,3-thiazolidin-3-ium-4-one

Systemtic Name: 3,5-ditert-butyl-5-(4-hydroxyphenyl)-2-methylidene-3-(4-methylpiperazin-1-yl)-1,3-thiazolidin-3-ium-4-one Openeye Name: 3,5-ditert-butyl-5-(4-hydroxyphenyl)-2-methylene-3-(4-methylpiperazin-1-yl)thiazolidin-3-ium-4-one CAS Name: 3,5-ditert-butyl-5-(4-hydroxyphenyl)-2-methylene-3-(4-methyl-1-piperazinyl)-4-thiazolidin-3-iumone IUPAC Name: 3,5-ditert-butyl-5-(4-hydroxyphenyl)-2-methylidene-3-(4-methylpiperazin-1-yl)-1,3-thiazolidin-3-ium-4-one Traditional Name: 3,5-ditert-butyl-5-(4-hydroxyphenyl)-2-methylene-3-(4-methylpiperazino)thiazolidin-3-ium-4-one Formula: C23H36N3O2S+ MolecularWeight: 418.61584

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1(C(=O)[N+](C(=C)S1)(C(C)(C)C)N2CCN(CC2)C)C3=CC=C(C=C3)O

Isomeric SMILES

CC(C)(C)C1(C(=O)[N+](C(=C)S1)(C(C)(C)C)N2CCN(CC2)C)C3=CC=C(C=C3)O

InChI

InChI=1S/C23H35N3O2S/c1-17-26(22(5,6)7,25-15-13-24(8)14-16-25)20(28)23(29-17,21(2,3)4)18-9-11-19(27)12-10-18/h9-12H,1,13-16H2,2-8H3/p+1