5-[(6-ethoxy-1,3-benzodioxol-5-yl)methylidene]-1-(4-fluorophenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-[(6-ethoxy-1,3-benzodioxol-5-yl)methylidene]-1-(4-fluorophenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[(6-ethoxy-1,3-benzodioxol-5-yl)methylene]-1-(4-fluorophenyl)-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[(6-ethoxy-1,3-benzodioxol-5-yl)methylidene]-1-(4-fluorophenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[(6-ethoxy-1,3-benzodioxol-5-yl)methylidene]-1-(4-fluorophenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-[(6-ethoxy-1,3-benzodioxol-5-yl)methylene]-1-(4-fluorophenyl)-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C20H15FN2O5S MolecularWeight: 414.406903

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1C=C3C(=O)NC(=S)N(C3=O)C4=CC=C(C=C4)F)OCO2

Isomeric SMILES

CCOC1=CC2=C(C=C1C=C3C(=O)NC(=S)N(C3=O)C4=CC=C(C=C4)F)OCO2

InChI

InChI=1S/C20H15FN2O5S/c1-2-26-15-9-17-16(27-10-28-17)8-11(15)7-14-18(24)22-20(29)23(19(14)25)13-5-3-12(21)4-6-13/h3-9H,2,10H2,1H3,(H,22,24,29)