5-(benzimidazol-2-ylidenemethyl)-3-(4-methoxyphenyl)-6-oxidanylidene-2-sulfanylidene-pyrimidin-4-olate

Systemtic Name: 5-(benzimidazol-2-ylidenemethyl)-3-(4-methoxyphenyl)-6-oxidanylidene-2-sulfanylidene-pyrimidin-4-olate Openeye Name: 5-(benzimidazol-2-ylidenemethyl)-3-(4-methoxyphenyl)-6-oxo-2-thioxo-pyrimidin-4-olate CAS Name: 5-(2-benzimidazolylidenemethyl)-3-(4-methoxyphenyl)-6-oxo-2-sulfanylidene-4-pyrimidinolate IUPAC Name: 5-(benzimidazol-2-ylidenemethyl)-3-(4-methoxyphenyl)-6-oxo-2-sulfanylidenepyrimidin-4-olate Traditional Name: 5-(benzimidazol-2-ylidenemethyl)-6-keto-3-(4-methoxyphenyl)-2-thioxo-pyrimidin-4-olate Formula: C19H13N4O3S- MolecularWeight: 377.39652

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=C(C(=O)NC2=S)C=C3N=C4C=CC=CC4=N3)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=C(C(=O)NC2=S)C=C3N=C4C=CC=CC4=N3)[O-]

InChI

InChI=1S/C19H14N4O3S/c1-26-12-8-6-11(7-9-12)23-18(25)13(17(24)22-19(23)27)10-16-20-14-4-2-3-5-15(14)21-16/h2-10,25H,1H3,(H,22,24,27)/p-1