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

Systemtic Name: 1-ethyl-5-[(5-nitrothiophen-2-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 1-ethyl-5-[(5-nitro-2-thienyl)methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 1-ethyl-5-[(5-nitro-2-thiophenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 1-ethyl-5-[(5-nitrothiophen-2-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 1-ethyl-5-[(5-nitro-2-thienyl)methylene]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C11H9N3O4S2 MolecularWeight: 311.33686

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C(=CC2=CC=C(S2)[N+](=O)[O-])C(=O)NC1=S

Isomeric SMILES

CCN1C(=O)C(=CC2=CC=C(S2)[N+](=O)[O-])C(=O)NC1=S

InChI

InChI=1S/C11H9N3O4S2/c1-2-13-10(16)7(9(15)12-11(13)19)5-6-3-4-8(20-6)14(17)18/h3-5H,2H2,1H3,(H,12,15,19)