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

Systemtic Name: (5Z)-5-[(2,4-diethoxyphenyl)methylidene]-1-(4-methylphenyl)-6-oxidanylidene-2-sulfanylidene-pyrimidin-4-olate Openeye Name: (5Z)-5-[(2,4-diethoxyphenyl)methylene]-6-oxo-1-(p-tolyl)-2-thioxo-pyrimidin-4-olate CAS Name: (5Z)-5-[(2,4-diethoxyphenyl)methylidene]-1-(4-methylphenyl)-6-oxo-2-sulfanylidene-4-pyrimidinolate IUPAC Name: (5Z)-5-[(2,4-diethoxyphenyl)methylidene]-1-(4-methylphenyl)-6-oxo-2-sulfanylidenepyrimidin-4-olate Traditional Name: (5Z)-5-(2,4-diethoxybenzylidene)-6-keto-1-(p-tolyl)-2-thioxo-pyrimidin-4-olate Formula: C22H21N2O4S- MolecularWeight: 409.47814

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1)C=C2C(=NC(=S)N(C2=O)C3=CC=C(C=C3)C)[O-])OCC

Isomeric SMILES

CCOC1=CC(=C(C=C1)/C=C\2/C(=NC(=S)N(C2=O)C3=CC=C(C=C3)C)[O-])OCC

InChI

InChI=1S/C22H22N2O4S/c1-4-27-17-11-8-15(19(13-17)28-5-2)12-18-20(25)23-22(29)24(21(18)26)16-9-6-14(3)7-10-16/h6-13H,4-5H2,1-3H3,(H,23,25,29)/p-1/b18-12-