(5Z)-1-(4-methylphenyl)-5-[(5-nitrofuran-2-yl)methylidene]-6-oxidanylidene-2-sulfanylidene-pyrimidin-4-olate

Systemtic Name: (5Z)-1-(4-methylphenyl)-5-[(5-nitrofuran-2-yl)methylidene]-6-oxidanylidene-2-sulfanylidene-pyrimidin-4-olate Openeye Name: (5Z)-5-[(5-nitro-2-furyl)methylene]-6-oxo-1-(p-tolyl)-2-thioxo-pyrimidin-4-olate CAS Name: (5Z)-1-(4-methylphenyl)-5-[(5-nitro-2-furanyl)methylidene]-6-oxo-2-sulfanylidene-4-pyrimidinolate IUPAC Name: (5Z)-1-(4-methylphenyl)-5-[(5-nitrofuran-2-yl)methylidene]-6-oxo-2-sulfanylidenepyrimidin-4-olate Traditional Name: (5Z)-6-keto-5-[(5-nitro-2-furyl)methylene]-1-(p-tolyl)-2-thioxo-pyrimidin-4-olate Formula: C16H10N3O5S- MolecularWeight: 356.3327

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)C(=CC3=CC=C(O3)[N+](=O)[O-])C(=NC2=S)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)/C(=C\C3=CC=C(O3)[N+](=O)[O-])/C(=NC2=S)[O-]

InChI

InChI=1S/C16H11N3O5S/c1-9-2-4-10(5-3-9)18-15(21)12(14(20)17-16(18)25)8-11-6-7-13(24-11)19(22)23/h2-8H,1H3,(H,17,20,25)/p-1/b12-8-