5-[[2-(dimethylazaniumyl)ethylamino]methylidene]-6-oxidanylidene-2-sulfanylidene-1-(2,4,6-trimethylphenyl)pyrimidin-4-olate

Systemtic Name: 5-[[2-(dimethylazaniumyl)ethylamino]methylidene]-6-oxidanylidene-2-sulfanylidene-1-(2,4,6-trimethylphenyl)pyrimidin-4-olate Openeye Name: 5-[[2-(dimethylammonio)ethylamino]methylene]-6-oxo-2-thioxo-1-(2,4,6-trimethylphenyl)pyrimidin-4-olate CAS Name: 5-[[2-(dimethylammonio)ethylamino]methylidene]-6-oxo-2-sulfanylidene-1-(2,4,6-trimethylphenyl)-4-pyrimidinolate IUPAC Name: 5-[[2-(dimethylazaniumyl)ethylamino]methylidene]-6-oxo-2-sulfanylidene-1-(2,4,6-trimethylphenyl)pyrimidin-4-olate Traditional Name: 5-[[2-(dimethylammonio)ethylamino]methylene]-6-keto-1-mesityl-2-thioxo-pyrimidin-4-olate Formula: C18H24N4O2S MolecularWeight: 360.47376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)N2C(=O)C(=CNCC[NH+](C)C)C(=NC2=S)[O-])C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)N2C(=O)C(=CNCC[NH+](C)C)C(=NC2=S)[O-])C

InChI

InChI=1S/C18H24N4O2S/c1-11-8-12(2)15(13(3)9-11)22-17(24)14(16(23)20-18(22)25)10-19-6-7-21(4)5/h8-10,19H,6-7H2,1-5H3,(H,20,23,25)