3-methyl-2-(3-oxidanylidene-4,4-diphenyl-1,2-thiazolidin-2-yl)butanoic acid

Systemtic Name: 3-methyl-2-(3-oxidanylidene-4,4-diphenyl-1,2-thiazolidin-2-yl)butanoic acid Openeye Name: 3-methyl-2-(3-oxo-4,4-diphenyl-isothiazolidin-2-yl)butanoic acid CAS Name: 3-methyl-2-(3-oxo-4,4-diphenyl-2-isothiazolidinyl)butanoic acid IUPAC Name: 3-methyl-2-(3-oxo-4,4-diphenyl-1,2-thiazolidin-2-yl)butanoic acid Traditional Name: 2-(3-keto-4,4-diphenyl-isothiazolidin-2-yl)-3-methyl-butyric acid Formula: C20H21NO3S MolecularWeight: 355.45064

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)N1C(=O)C(CS1)(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC(C)C(C(=O)O)N1C(=O)C(CS1)(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C20H21NO3S/c1-14(2)17(18(22)23)21-19(24)20(13-25-21,15-9-5-3-6-10-15)16-11-7-4-8-12-16/h3-12,14,17H,13H2,1-2H3,(H,22,23)