3,5-ditert-butyl-2-(4-hydroxyphenyl)-2-methyl-3-(methylsulfanylmethyl)-1,3-thiazolidin-3-ium-4-one

Systemtic Name: 3,5-ditert-butyl-2-(4-hydroxyphenyl)-2-methyl-3-(methylsulfanylmethyl)-1,3-thiazolidin-3-ium-4-one Openeye Name: 3,5-ditert-butyl-2-(4-hydroxyphenyl)-2-methyl-3-(methylsulfanylmethyl)thiazolidin-3-ium-4-one CAS Name: 3,5-ditert-butyl-2-(4-hydroxyphenyl)-2-methyl-3-[(methylthio)methyl]-4-thiazolidin-3-iumone IUPAC Name: 3,5-ditert-butyl-2-(4-hydroxyphenyl)-2-methyl-3-(methylsulfanylmethyl)-1,3-thiazolidin-3-ium-4-one Traditional Name: 3,5-ditert-butyl-2-(4-hydroxyphenyl)-2-methyl-3-[(methylthio)methyl]thiazolidin-3-ium-4-one Formula: C20H32NO2S2+ MolecularWeight: 382.60358

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1([N+](C(=O)C(S1)C(C)(C)C)(CSC)C(C)(C)C)C2=CC=C(C=C2)O

Isomeric SMILES

CC1([N+](C(=O)C(S1)C(C)(C)C)(CSC)C(C)(C)C)C2=CC=C(C=C2)O

InChI

InChI=1S/C20H31NO2S2/c1-18(2,3)16-17(23)21(13-24-8,19(4,5)6)20(7,25-16)14-9-11-15(22)12-10-14/h9-12,16H,13H2,1-8H3/p+1