2,2-dimethyl-5-[(5-methylsulfanyl-3-phenylmethoxy-thiophen-2-yl)methylidene]-1,3-dioxane-4,6-dione

Systemtic Name: 2,2-dimethyl-5-[(5-methylsulfanyl-3-phenylmethoxy-thiophen-2-yl)methylidene]-1,3-dioxane-4,6-dione Openeye Name: 5-[(3-benzyloxy-5-methylsulfanyl-2-thienyl)methylene]-2,2-dimethyl-1,3-dioxane-4,6-dione CAS Name: 2,2-dimethyl-5-[[5-(methylthio)-3-phenylmethoxy-2-thiophenyl]methylidene]-1,3-dioxane-4,6-dione IUPAC Name: 2,2-dimethyl-5-[(5-methylsulfanyl-3-phenylmethoxythiophen-2-yl)methylidene]-1,3-dioxane-4,6-dione Traditional Name: 5-[[3-benzoxy-5-(methylthio)-2-thienyl]methylene]-2,2-dimethyl-1,3-dioxane-4,6-quinone Formula: C19H18O5S2 MolecularWeight: 390.47322

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OC(=O)C(=CC2=C(C=C(S2)SC)OCC3=CC=CC=C3)C(=O)O1)C

Isomeric SMILES

CC1(OC(=O)C(=CC2=C(C=C(S2)SC)OCC3=CC=CC=C3)C(=O)O1)C

InChI

InChI=1S/C19H18O5S2/c1-19(2)23-17(20)13(18(21)24-19)9-15-14(10-16(25-3)26-15)22-11-12-7-5-4-6-8-12/h4-10H,11H2,1-3H3