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

Systemtic Name: 5-[(3-ethoxy-5-iodanyl-4-phenylmethoxy-phenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[(4-benzyloxy-3-ethoxy-5-iodo-phenyl)methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[(3-ethoxy-5-iodo-4-phenylmethoxyphenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[(3-ethoxy-5-iodo-4-phenylmethoxyphenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-(4-benzoxy-3-ethoxy-5-iodo-benzylidene)-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C20H17IN2O4S MolecularWeight: 508.32945

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=C2C(=O)NC(=S)NC2=O)I)OCC3=CC=CC=C3

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C=C2C(=O)NC(=S)NC2=O)I)OCC3=CC=CC=C3

InChI

InChI=1S/C20H17IN2O4S/c1-2-26-16-10-13(8-14-18(24)22-20(28)23-19(14)25)9-15(21)17(16)27-11-12-6-4-3-5-7-12/h3-10H,2,11H2,1H3,(H2,22,23,24,25,28)