(5Z)-1-(2-ethylphenyl)-6-oxidanylidene-2-sulfanylidene-5-[(1,2,5-trimethylpyrrol-3-yl)methylidene]pyrimidin-4-olate

Systemtic Name: (5Z)-1-(2-ethylphenyl)-6-oxidanylidene-2-sulfanylidene-5-[(1,2,5-trimethylpyrrol-3-yl)methylidene]pyrimidin-4-olate Openeye Name: (5Z)-1-(2-ethylphenyl)-6-oxo-2-thioxo-5-[(1,2,5-trimethylpyrrol-3-yl)methylene]pyrimidin-4-olate CAS Name: (5Z)-1-(2-ethylphenyl)-6-oxo-2-sulfanylidene-5-[(1,2,5-trimethyl-3-pyrrolyl)methylidene]-4-pyrimidinolate IUPAC Name: (5Z)-1-(2-ethylphenyl)-6-oxo-2-sulfanylidene-5-[(1,2,5-trimethylpyrrol-3-yl)methylidene]pyrimidin-4-olate Traditional Name: (5Z)-1-(2-ethylphenyl)-6-keto-2-thioxo-5-[(1,2,5-trimethylpyrrol-3-yl)methylene]pyrimidin-4-olate Formula: C20H20N3O2S- MolecularWeight: 366.4567

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1N2C(=O)C(=CC3=C(N(C(=C3)C)C)C)C(=NC2=S)[O-]

Isomeric SMILES

CCC1=CC=CC=C1N2C(=O)/C(=C\C3=C(N(C(=C3)C)C)C)/C(=NC2=S)[O-]

InChI

InChI=1S/C20H21N3O2S/c1-5-14-8-6-7-9-17(14)23-19(25)16(18(24)21-20(23)26)11-15-10-12(2)22(4)13(15)3/h6-11H,5H2,1-4H3,(H,21,24,26)/p-1/b16-11-