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

Systemtic Name: [2-(4-iodophenyl)-4-methyl-6-sulfanylidene-pyrimidin-5-ylidene]-methoxy-methanolate Openeye Name: [2-(4-iodophenyl)-4-methyl-6-thioxo-pyrimidin-5-ylidene]-methoxy-methanolate CAS Name: [2-(4-iodophenyl)-4-methyl-6-sulfanylidene-5-pyrimidinylidene]-methoxymethanolate IUPAC Name: [2-(4-iodophenyl)-4-methyl-6-sulfanylidenepyrimidin-5-ylidene]-methoxymethanolate Traditional Name: [2-(4-iodophenyl)-4-methyl-6-thioxo-pyrimidin-5-ylidene]-methoxy-methanolate Formula: C13H10IN2O2S- MolecularWeight: 385.20017

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H11IN2O2S/c1-7-10(13(17)18-2)12(19)16-11(15-7)8-3-5-9(14)6-4-8/h3-6,17H,1-2H3/p-1