2,2-dimethyl-5-[[[2-(2-methylphenoxy)phenyl]amino]-methylsulfanyl-methylidene]-1,3-dioxane-4,6-dione

Systemtic Name: 2,2-dimethyl-5-[[[2-(2-methylphenoxy)phenyl]amino]-methylsulfanyl-methylidene]-1,3-dioxane-4,6-dione Openeye Name: 2,2-dimethyl-5-[[2-(2-methylphenoxy)anilino]-methylsulfanyl-methylene]-1,3-dioxane-4,6-dione CAS Name: 2,2-dimethyl-5-[[2-(2-methylphenoxy)anilino]-(methylthio)methylidene]-1,3-dioxane-4,6-dione IUPAC Name: 2,2-dimethyl-5-[[2-(2-methylphenoxy)anilino]-methylsulfanylmethylidene]-1,3-dioxane-4,6-dione Traditional Name: 2,2-dimethyl-5-[[2-(2-methylphenoxy)anilino]-(methylthio)methylene]-1,3-dioxane-4,6-quinone Formula: C21H21NO5S MolecularWeight: 399.46014

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OC2=CC=CC=C2NC(=C3C(=O)OC(OC3=O)(C)C)SC

Isomeric SMILES

CC1=CC=CC=C1OC2=CC=CC=C2NC(=C3C(=O)OC(OC3=O)(C)C)SC

InChI

InChI=1S/C21H21NO5S/c1-13-9-5-7-11-15(13)25-16-12-8-6-10-14(16)22-18(28-4)17-19(23)26-21(2,3)27-20(17)24/h5-12,22H,1-4H3