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

Systemtic Name: 5-(benzimidazol-2-ylidenemethyl)-3-(2-methylphenyl)-6-oxidanylidene-2-sulfanylidene-pyrimidin-4-olate Openeye Name: 5-(benzimidazol-2-ylidenemethyl)-3-(o-tolyl)-6-oxo-2-thioxo-pyrimidin-4-olate CAS Name: 5-(2-benzimidazolylidenemethyl)-3-(2-methylphenyl)-6-oxo-2-sulfanylidene-4-pyrimidinolate IUPAC Name: 5-(benzimidazol-2-ylidenemethyl)-3-(2-methylphenyl)-6-oxo-2-sulfanylidenepyrimidin-4-olate Traditional Name: 5-(benzimidazol-2-ylidenemethyl)-6-keto-3-(o-tolyl)-2-thioxo-pyrimidin-4-olate Formula: C19H13N4O2S- MolecularWeight: 361.39712

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=C(C(=O)NC2=S)C=C3N=C4C=CC=CC4=N3)[O-]

Isomeric SMILES

CC1=CC=CC=C1N2C(=C(C(=O)NC2=S)C=C3N=C4C=CC=CC4=N3)[O-]

InChI

InChI=1S/C19H14N4O2S/c1-11-6-2-5-9-15(11)23-18(25)12(17(24)22-19(23)26)10-16-20-13-7-3-4-8-14(13)21-16/h2-10,25H,1H3,(H,22,24,26)/p-1