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

Systemtic Name: 5-[[3-ethoxy-4-[(4-fluorophenyl)methoxy]-5-iodanyl-phenyl]methylidene]-1-methyl-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[[3-ethoxy-4-[(4-fluorophenyl)methoxy]-5-iodo-phenyl]methylene]-1-methyl-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[[3-ethoxy-4-[(4-fluorophenyl)methoxy]-5-iodophenyl]methylidene]-1-methyl-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[[3-ethoxy-4-[(4-fluorophenyl)methoxy]-5-iodophenyl]methylidene]-1-methyl-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-[3-ethoxy-4-(4-fluorobenzyl)oxy-5-iodo-benzylidene]-1-methyl-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C21H18FIN2O4S MolecularWeight: 540.346493

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=C2C(=O)NC(=S)N(C2=O)C)I)OCC3=CC=C(C=C3)F

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C=C2C(=O)NC(=S)N(C2=O)C)I)OCC3=CC=C(C=C3)F

InChI

InChI=1S/C21H18FIN2O4S/c1-3-28-17-10-13(8-15-19(26)24-21(30)25(2)20(15)27)9-16(23)18(17)29-11-12-4-6-14(22)7-5-12/h4-10H,3,11H2,1-2H3,(H,24,26,30)