(5Z)-5-[(2,4-dimethoxy-5-nitro-phenyl)methylidene]-1-(3-ethoxyphenyl)-6-oxidanylidene-2-sulfanylidene-pyrimidin-4-olate

Systemtic Name: (5Z)-5-[(2,4-dimethoxy-5-nitro-phenyl)methylidene]-1-(3-ethoxyphenyl)-6-oxidanylidene-2-sulfanylidene-pyrimidin-4-olate Openeye Name: (5Z)-5-[(2,4-dimethoxy-5-nitro-phenyl)methylene]-1-(3-ethoxyphenyl)-6-oxo-2-thioxo-pyrimidin-4-olate CAS Name: (5Z)-5-[(2,4-dimethoxy-5-nitrophenyl)methylidene]-1-(3-ethoxyphenyl)-6-oxo-2-sulfanylidene-4-pyrimidinolate IUPAC Name: (5Z)-5-[(2,4-dimethoxy-5-nitrophenyl)methylidene]-1-(3-ethoxyphenyl)-6-oxo-2-sulfanylidenepyrimidin-4-olate Traditional Name: (5Z)-5-(2,4-dimethoxy-5-nitro-benzylidene)-6-keto-1-m-phenetyl-2-thioxo-pyrimidin-4-olate Formula: C21H18N3O7S- MolecularWeight: 456.44852

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)N2C(=O)C(=CC3=CC(=C(C=C3OC)OC)[N+](=O)[O-])C(=NC2=S)[O-]

Isomeric SMILES

CCOC1=CC=CC(=C1)N2C(=O)/C(=C\C3=CC(=C(C=C3OC)OC)[N+](=O)[O-])/C(=NC2=S)[O-]

InChI

InChI=1S/C21H19N3O7S/c1-4-31-14-7-5-6-13(10-14)23-20(26)15(19(25)22-21(23)32)8-12-9-16(24(27)28)18(30-3)11-17(12)29-2/h5-11H,4H2,1-3H3,(H,22,25,32)/p-1/b15-8-