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

Systemtic Name: (5E)-1-(4-ethoxyphenyl)-5-[(3-iodanyl-4-methoxy-phenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: (5E)-1-(4-ethoxyphenyl)-5-[(3-iodo-4-methoxy-phenyl)methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: (5E)-1-(4-ethoxyphenyl)-5-[(3-iodo-4-methoxyphenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: (5E)-1-(4-ethoxyphenyl)-5-[(3-iodo-4-methoxyphenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: (5E)-5-(3-iodo-4-methoxy-benzylidene)-1-p-phenetyl-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C20H17IN2O4S MolecularWeight: 508.32945

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=O)C(=CC3=CC(=C(C=C3)OC)I)C(=O)NC2=S

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=O)/C(=C/C3=CC(=C(C=C3)OC)I)/C(=O)NC2=S

InChI

InChI=1S/C20H17IN2O4S/c1-3-27-14-7-5-13(6-8-14)23-19(25)15(18(24)22-20(23)28)10-12-4-9-17(26-2)16(21)11-12/h4-11H,3H2,1-2H3,(H,22,24,28)/b15-10+