(5Z)-5-[[2,5-dimethyl-1-(2-methyl-4-nitro-phenyl)pyrrol-3-yl]methylidene]-1-ethyl-6-oxidanylidene-2-sulfanylidene-pyrimidin-4-olate

Systemtic Name: (5Z)-5-[[2,5-dimethyl-1-(2-methyl-4-nitro-phenyl)pyrrol-3-yl]methylidene]-1-ethyl-6-oxidanylidene-2-sulfanylidene-pyrimidin-4-olate Openeye Name: (5Z)-5-[[2,5-dimethyl-1-(2-methyl-4-nitro-phenyl)pyrrol-3-yl]methylene]-1-ethyl-6-oxo-2-thioxo-pyrimidin-4-olate CAS Name: (5Z)-5-[[2,5-dimethyl-1-(2-methyl-4-nitrophenyl)-3-pyrrolyl]methylidene]-1-ethyl-6-oxo-2-sulfanylidene-4-pyrimidinolate IUPAC Name: (5Z)-5-[[2,5-dimethyl-1-(2-methyl-4-nitrophenyl)pyrrol-3-yl]methylidene]-1-ethyl-6-oxo-2-sulfanylidenepyrimidin-4-olate Traditional Name: (5Z)-5-[[2,5-dimethyl-1-(2-methyl-4-nitro-phenyl)pyrrol-3-yl]methylene]-1-ethyl-6-keto-2-thioxo-pyrimidin-4-olate Formula: C20H19N4O4S- MolecularWeight: 411.45426

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C(=CC2=C(N(C(=C2)C)C3=C(C=C(C=C3)[N+](=O)[O-])C)C)C(=NC1=S)[O-]

Isomeric SMILES

CCN1C(=O)/C(=C\C2=C(N(C(=C2)C)C3=C(C=C(C=C3)[N+](=O)[O-])C)C)/C(=NC1=S)[O-]

InChI

InChI=1S/C20H20N4O4S/c1-5-22-19(26)16(18(25)21-20(22)29)10-14-9-12(3)23(13(14)4)17-7-6-15(24(27)28)8-11(17)2/h6-10H,5H2,1-4H3,(H,21,25,29)/p-1/b16-10-