[2-(2-bromanyl-5-methoxy-phenyl)-4-methyl-6-sulfanylidene-pyrimidin-5-ylidene]-methoxy-methanolate

Systemtic Name: [2-(2-bromanyl-5-methoxy-phenyl)-4-methyl-6-sulfanylidene-pyrimidin-5-ylidene]-methoxy-methanolate Openeye Name: [2-(2-bromo-5-methoxy-phenyl)-4-methyl-6-thioxo-pyrimidin-5-ylidene]-methoxy-methanolate CAS Name: [2-(2-bromo-5-methoxyphenyl)-4-methyl-6-sulfanylidene-5-pyrimidinylidene]-methoxymethanolate IUPAC Name: [2-(2-bromo-5-methoxyphenyl)-4-methyl-6-sulfanylidenepyrimidin-5-ylidene]-methoxymethanolate Traditional Name: [2-(2-bromo-5-methoxy-phenyl)-4-methyl-6-thioxo-pyrimidin-5-ylidene]-methoxy-methanolate Formula: C14H12BrN2O3S- MolecularWeight: 368.22568

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=S)C1=C([O-])OC)C2=C(C=CC(=C2)OC)Br

Isomeric SMILES

CC1=NC(=NC(=S)C1=C([O-])OC)C2=C(C=CC(=C2)OC)Br

InChI

InChI=1S/C14H13BrN2O3S/c1-7-11(14(18)20-3)13(21)17-12(16-7)9-6-8(19-2)4-5-10(9)15/h4-6,18H,1-3H3/p-1