2-(5-chloranyl-3-oxidanylidene-4,4-diphenyl-1,2-thiazolidin-2-yl)-3-methyl-butanoic acid

Systemtic Name: 2-(5-chloranyl-3-oxidanylidene-4,4-diphenyl-1,2-thiazolidin-2-yl)-3-methyl-butanoic acid Openeye Name: 2-(5-chloro-3-oxo-4,4-diphenyl-isothiazolidin-2-yl)-3-methyl-butanoic acid CAS Name: 2-(5-chloro-3-oxo-4,4-diphenyl-2-isothiazolidinyl)-3-methylbutanoic acid IUPAC Name: 2-(5-chloro-3-oxo-4,4-diphenyl-1,2-thiazolidin-2-yl)-3-methylbutanoic acid Traditional Name: 2-(5-chloro-3-keto-4,4-diphenyl-isothiazolidin-2-yl)-3-methyl-butyric acid Formula: C20H20ClNO3S MolecularWeight: 389.8957

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)N1C(=O)C(C(S1)Cl)(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC(C)C(C(=O)O)N1C(=O)C(C(S1)Cl)(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C20H20ClNO3S/c1-13(2)16(17(23)24)22-19(25)20(18(21)26-22,14-9-5-3-6-10-14)15-11-7-4-8-12-15/h3-13,16,18H,1-2H3,(H,23,24)