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

Systemtic Name: 5-[(5-nitrofuran-2-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[(5-nitro-2-furyl)methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[(5-nitro-2-furanyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[(5-nitrofuran-2-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-[(5-nitro-2-furyl)methylene]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C9H5N3O5S MolecularWeight: 267.2181

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(OC(=C1)[N+](=O)[O-])C=C2C(=O)NC(=S)NC2=O

Isomeric SMILES

C1=C(OC(=C1)[N+](=O)[O-])C=C2C(=O)NC(=S)NC2=O

InChI

InChI=1S/C9H5N3O5S/c13-7-5(8(14)11-9(18)10-7)3-4-1-2-6(17-4)12(15)16/h1-3H,(H2,10,11,13,14,18)