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

Systemtic Name: 1-(3-chlorophenyl)-5-[(3-ethoxy-5-iodanyl-4-methoxy-phenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 1-(3-chlorophenyl)-5-[(3-ethoxy-5-iodo-4-methoxy-phenyl)methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 1-(3-chlorophenyl)-5-[(3-ethoxy-5-iodo-4-methoxyphenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 1-(3-chlorophenyl)-5-[(3-ethoxy-5-iodo-4-methoxyphenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 1-(3-chlorophenyl)-5-(3-ethoxy-5-iodo-4-methoxy-benzylidene)-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C20H16ClIN2O4S MolecularWeight: 542.77451

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=C2C(=O)NC(=S)N(C2=O)C3=CC(=CC=C3)Cl)I)OC

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C=C2C(=O)NC(=S)N(C2=O)C3=CC(=CC=C3)Cl)I)OC

InChI

InChI=1S/C20H16ClIN2O4S/c1-3-28-16-9-11(8-15(22)17(16)27-2)7-14-18(25)23-20(29)24(19(14)26)13-6-4-5-12(21)10-13/h4-10H,3H2,1-2H3,(H,23,25,29)