5-[(3,5-dimethoxy-4-oxidanyl-phenyl)methylidene]-1-(2,4-dimethoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-[(3,5-dimethoxy-4-oxidanyl-phenyl)methylidene]-1-(2,4-dimethoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 1-(2,4-dimethoxyphenyl)-5-[(4-hydroxy-3,5-dimethoxy-phenyl)methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 1-(2,4-dimethoxyphenyl)-5-[(4-hydroxy-3,5-dimethoxyphenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 1-(2,4-dimethoxyphenyl)-5-[(4-hydroxy-3,5-dimethoxyphenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 1-(2,4-dimethoxyphenyl)-5-(4-hydroxy-3,5-dimethoxy-benzylidene)-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C21H20N2O7S MolecularWeight: 444.4577

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)N2C(=O)C(=CC3=CC(=C(C(=C3)OC)O)OC)C(=O)NC2=S)OC

Isomeric SMILES

COC1=CC(=C(C=C1)N2C(=O)C(=CC3=CC(=C(C(=C3)OC)O)OC)C(=O)NC2=S)OC

InChI

InChI=1S/C21H20N2O7S/c1-27-12-5-6-14(15(10-12)28-2)23-20(26)13(19(25)22-21(23)31)7-11-8-16(29-3)18(24)17(9-11)30-4/h5-10,24H,1-4H3,(H,22,25,31)