5-[[3,5-bis(iodanyl)-2-methoxy-phenyl]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-[[3,5-bis(iodanyl)-2-methoxy-phenyl]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[(3,5-diiodo-2-methoxy-phenyl)methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[(3,5-diiodo-2-methoxyphenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[(3,5-diiodo-2-methoxyphenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-(3,5-diiodo-2-methoxy-benzylidene)-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C12H8I2N2O3S MolecularWeight: 514.07746

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1C=C2C(=O)NC(=S)NC2=O)I)I

Isomeric SMILES

COC1=C(C=C(C=C1C=C2C(=O)NC(=S)NC2=O)I)I

InChI

InChI=1S/C12H8I2N2O3S/c1-19-9-5(2-6(13)4-8(9)14)3-7-10(17)15-12(20)16-11(7)18/h2-4H,1H3,(H2,15,16,17,18,20)