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

Systemtic Name: 1-(4-ethylphenyl)-5-[(3-iodanyl-4-methoxy-phenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 1-(4-ethylphenyl)-5-[(3-iodo-4-methoxy-phenyl)methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 1-(4-ethylphenyl)-5-[(3-iodo-4-methoxyphenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 1-(4-ethylphenyl)-5-[(3-iodo-4-methoxyphenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 1-(4-ethylphenyl)-5-(3-iodo-4-methoxy-benzylidene)-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C20H17IN2O3S MolecularWeight: 492.33005

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2C(=O)C(=CC3=CC(=C(C=C3)OC)I)C(=O)NC2=S

Isomeric SMILES

CCC1=CC=C(C=C1)N2C(=O)C(=CC3=CC(=C(C=C3)OC)I)C(=O)NC2=S

InChI

InChI=1S/C20H17IN2O3S/c1-3-12-4-7-14(8-5-12)23-19(25)15(18(24)22-20(23)27)10-13-6-9-17(26-2)16(21)11-13/h4-11H,3H2,1-2H3,(H,22,24,27)