5-methoxy-2-[5-(2-methoxyphenoxy)-2-sulfanylidene-1H-pyrimidin-6-yl]phenolate

Systemtic Name: 5-methoxy-2-[5-(2-methoxyphenoxy)-2-sulfanylidene-1H-pyrimidin-6-yl]phenolate Openeye Name: 5-methoxy-2-[5-(2-methoxyphenoxy)-2-thioxo-1H-pyrimidin-6-yl]phenolate CAS Name: 5-methoxy-2-[5-(2-methoxyphenoxy)-2-sulfanylidene-1H-pyrimidin-6-yl]phenolate IUPAC Name: 5-methoxy-2-[5-(2-methoxyphenoxy)-2-sulfanylidene-1H-pyrimidin-6-yl]phenolate Traditional Name: 5-methoxy-2-[5-(2-methoxyphenoxy)-2-thioxo-1H-pyrimidin-6-yl]phenolate Formula: C18H15N2O4S- MolecularWeight: 355.3877

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C2=C(C=NC(=S)N2)OC3=CC=CC=C3OC)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)C2=C(C=NC(=S)N2)OC3=CC=CC=C3OC)[O-]

InChI

InChI=1S/C18H16N2O4S/c1-22-11-7-8-12(13(21)9-11)17-16(10-19-18(25)20-17)24-15-6-4-3-5-14(15)23-2/h3-10,21H,1-2H3,(H,19,20,25)/p-1