1-(1,3-benzodioxol-5-ylcarbonyl)-5-[(4-nitrophenyl)methylidene]-2-sulfanylidene-imidazolidin-4-one

Systemtic Name: 1-(1,3-benzodioxol-5-ylcarbonyl)-5-[(4-nitrophenyl)methylidene]-2-sulfanylidene-imidazolidin-4-one Openeye Name: 1-(1,3-benzodioxole-5-carbonyl)-5-[(4-nitrophenyl)methylene]-2-thioxo-imidazolidin-4-one CAS Name: 1-[1,3-benzodioxol-5-yl(oxo)methyl]-5-[(4-nitrophenyl)methylidene]-2-sulfanylidene-4-imidazolidinone IUPAC Name: 1-(1,3-benzodioxole-5-carbonyl)-5-[(4-nitrophenyl)methylidene]-2-sulfanylideneimidazolidin-4-one Traditional Name: 5-(4-nitrobenzylidene)-1-piperonyloyl-2-thioxo-4-imidazolidinone Formula: C18H11N3O6S MolecularWeight: 397.36144

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)N3C(=CC4=CC=C(C=C4)[N+](=O)[O-])C(=O)NC3=S

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)N3C(=CC4=CC=C(C=C4)[N+](=O)[O-])C(=O)NC3=S

InChI

InChI=1S/C18H11N3O6S/c22-16-13(7-10-1-4-12(5-2-10)21(24)25)20(18(28)19-16)17(23)11-3-6-14-15(8-11)27-9-26-14/h1-8H,9H2,(H,19,22,28)