(5E)-5-[(2,5-dimethyl-1-phenyl-pyrrol-3-yl)methylidene]-1-(4-methylphenyl)-6-oxidanylidene-2-sulfanylidene-pyrimidin-4-olate

Systemtic Name: (5E)-5-[(2,5-dimethyl-1-phenyl-pyrrol-3-yl)methylidene]-1-(4-methylphenyl)-6-oxidanylidene-2-sulfanylidene-pyrimidin-4-olate Openeye Name: (5E)-5-[(2,5-dimethyl-1-phenyl-pyrrol-3-yl)methylene]-6-oxo-1-(p-tolyl)-2-thioxo-pyrimidin-4-olate CAS Name: (5E)-5-[(2,5-dimethyl-1-phenyl-3-pyrrolyl)methylidene]-1-(4-methylphenyl)-6-oxo-2-sulfanylidene-4-pyrimidinolate IUPAC Name: (5E)-5-[(2,5-dimethyl-1-phenylpyrrol-3-yl)methylidene]-1-(4-methylphenyl)-6-oxo-2-sulfanylidenepyrimidin-4-olate Traditional Name: (5E)-5-[(2,5-dimethyl-1-phenyl-pyrrol-3-yl)methylene]-6-keto-1-(p-tolyl)-2-thioxo-pyrimidin-4-olate Formula: C24H20N3O2S- MolecularWeight: 414.4995

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)C(=CC3=C(N(C(=C3)C)C4=CC=CC=C4)C)C(=NC2=S)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)/C(=C/C3=C(N(C(=C3)C)C4=CC=CC=C4)C)/C(=NC2=S)[O-]

InChI

InChI=1S/C24H21N3O2S/c1-15-9-11-20(12-10-15)27-23(29)21(22(28)25-24(27)30)14-18-13-16(2)26(17(18)3)19-7-5-4-6-8-19/h4-14H,1-3H3,(H,25,28,30)/p-1/b21-14+