6-oxidanylidene-3-(4-propan-2-ylphenyl)-5-(pyrrol-2-ylidenemethyl)-2-sulfanylidene-pyrimidin-4-olate

Systemtic Name: 6-oxidanylidene-3-(4-propan-2-ylphenyl)-5-(pyrrol-2-ylidenemethyl)-2-sulfanylidene-pyrimidin-4-olate Openeye Name: 3-(4-isopropylphenyl)-6-oxo-5-(pyrrol-2-ylidenemethyl)-2-thioxo-pyrimidin-4-olate CAS Name: 6-oxo-3-(4-propan-2-ylphenyl)-5-(2-pyrrolylidenemethyl)-2-sulfanylidene-4-pyrimidinolate IUPAC Name: 6-oxo-3-(4-propan-2-ylphenyl)-5-(pyrrol-2-ylidenemethyl)-2-sulfanylidenepyrimidin-4-olate Traditional Name: 6-keto-3-p-cumenyl-5-(pyrrol-2-ylidenemethyl)-2-thioxo-pyrimidin-4-olate Formula: C18H16N3O2S- MolecularWeight: 338.40354

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)N2C(=C(C(=O)NC2=S)C=C3C=CC=N3)[O-]

Isomeric SMILES

CC(C)C1=CC=C(C=C1)N2C(=C(C(=O)NC2=S)C=C3C=CC=N3)[O-]

InChI

InChI=1S/C18H17N3O2S/c1-11(2)12-5-7-14(8-6-12)21-17(23)15(16(22)20-18(21)24)10-13-4-3-9-19-13/h3-11,23H,1-2H3,(H,20,22,24)/p-1