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

Systemtic Name: methoxy-[4-methyl-2-(4-nitrophenyl)-6-sulfanylidene-pyrimidin-5-ylidene]methanolate Openeye Name: methoxy-[4-methyl-2-(4-nitrophenyl)-6-thioxo-pyrimidin-5-ylidene]methanolate CAS Name: methoxy-[4-methyl-2-(4-nitrophenyl)-6-sulfanylidene-5-pyrimidinylidene]methanolate IUPAC Name: methoxy-[4-methyl-2-(4-nitrophenyl)-6-sulfanylidenepyrimidin-5-ylidene]methanolate Traditional Name: methoxy-[4-methyl-2-(4-nitrophenyl)-6-thioxo-pyrimidin-5-ylidene]methanolate Formula: C13H10N3O4S- MolecularWeight: 304.3012

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H11N3O4S/c1-7-10(13(17)20-2)12(21)15-11(14-7)8-3-5-9(6-4-8)16(18)19/h3-6,17H,1-2H3/p-1