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

Systemtic Name: (5Z)-1-(2-methylphenyl)-6-oxidanylidene-5-[(1-phenylpyrrol-2-yl)methylidene]-2-sulfanylidene-pyrimidin-4-olate Openeye Name: (5Z)-1-(o-tolyl)-6-oxo-5-[(1-phenylpyrrol-2-yl)methylene]-2-thioxo-pyrimidin-4-olate CAS Name: (5Z)-1-(2-methylphenyl)-6-oxo-5-[(1-phenyl-2-pyrrolyl)methylidene]-2-sulfanylidene-4-pyrimidinolate IUPAC Name: (5Z)-1-(2-methylphenyl)-6-oxo-5-[(1-phenylpyrrol-2-yl)methylidene]-2-sulfanylidenepyrimidin-4-olate Traditional Name: (5Z)-6-keto-1-(o-tolyl)-5-[(1-phenylpyrrol-2-yl)methylene]-2-thioxo-pyrimidin-4-olate Formula: C22H16N3O2S- MolecularWeight: 386.44634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=O)C(=CC3=CC=CN3C4=CC=CC=C4)C(=NC2=S)[O-]

Isomeric SMILES

CC1=CC=CC=C1N2C(=O)/C(=C\C3=CC=CN3C4=CC=CC=C4)/C(=NC2=S)[O-]

InChI

InChI=1S/C22H17N3O2S/c1-15-8-5-6-12-19(15)25-21(27)18(20(26)23-22(25)28)14-17-11-7-13-24(17)16-9-3-2-4-10-16/h2-14H,1H3,(H,23,26,28)/p-1/b18-14-