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

Systemtic Name: (5Z)-5-[(2,5-dimethyl-1-phenyl-pyrrol-3-yl)methylidene]-1-(3-fluorophenyl)-6-oxidanylidene-2-sulfanylidene-pyrimidin-4-olate Openeye Name: (5Z)-5-[(2,5-dimethyl-1-phenyl-pyrrol-3-yl)methylene]-1-(3-fluorophenyl)-6-oxo-2-thioxo-pyrimidin-4-olate CAS Name: (5Z)-5-[(2,5-dimethyl-1-phenyl-3-pyrrolyl)methylidene]-1-(3-fluorophenyl)-6-oxo-2-sulfanylidene-4-pyrimidinolate IUPAC Name: (5Z)-5-[(2,5-dimethyl-1-phenylpyrrol-3-yl)methylidene]-1-(3-fluorophenyl)-6-oxo-2-sulfanylidenepyrimidin-4-olate Traditional Name: (5Z)-5-[(2,5-dimethyl-1-phenyl-pyrrol-3-yl)methylene]-1-(3-fluorophenyl)-6-keto-2-thioxo-pyrimidin-4-olate Formula: C23H17FN3O2S- MolecularWeight: 418.463383

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=CC=C2)C)C=C3C(=NC(=S)N(C3=O)C4=CC(=CC=C4)F)[O-]

Isomeric SMILES

CC1=CC(=C(N1C2=CC=CC=C2)C)/C=C\3/C(=NC(=S)N(C3=O)C4=CC(=CC=C4)F)[O-]

InChI

InChI=1S/C23H18FN3O2S/c1-14-11-16(15(2)26(14)18-8-4-3-5-9-18)12-20-21(28)25-23(30)27(22(20)29)19-10-6-7-17(24)13-19/h3-13H,1-2H3,(H,25,28,30)/p-1/b20-12-