(5E)-5-[(E)-3-(5-nitrofuran-2-yl)prop-2-enylidene]-6-oxidanylidene-2-sulfanylidene-pyrimidin-4-olate

Systemtic Name: (5E)-5-[(E)-3-(5-nitrofuran-2-yl)prop-2-enylidene]-6-oxidanylidene-2-sulfanylidene-pyrimidin-4-olate Openeye Name: (5E)-5-[(E)-3-(5-nitro-2-furyl)prop-2-enylidene]-6-oxo-2-thioxo-pyrimidin-4-olate CAS Name: (5E)-5-[(E)-3-(5-nitro-2-furanyl)prop-2-enylidene]-6-oxo-2-sulfanylidene-4-pyrimidinolate IUPAC Name: (5E)-5-[(E)-3-(5-nitrofuran-2-yl)prop-2-enylidene]-6-oxo-2-sulfanylidenepyrimidin-4-olate Traditional Name: (5E)-6-keto-5-[(E)-3-(5-nitro-2-furyl)prop-2-enylidene]-2-thioxo-pyrimidin-4-olate Formula: C11H6N3O5S- MolecularWeight: 292.24744

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=C(OC(=C1)[N+](=O)[O-])C=CC=C2C(=O)NC(=S)N=C2[O-]

Isomeric SMILES

C1=C(OC(=C1)[N+](=O)[O-])/C=C/C=C\2/C(=O)NC(=S)N=C2[O-]

InChI

InChI=1S/C11H7N3O5S/c15-9-7(10(16)13-11(20)12-9)3-1-2-6-4-5-8(19-6)14(17)18/h1-5H,(H2,12,13,15,16,20)/p-1/b2-1+