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

Systemtic Name: 5-(benzimidazol-2-ylidenemethyl)-6-oxidanylidene-3-prop-2-enyl-2-sulfanylidene-pyrimidin-4-olate Openeye Name: 3-allyl-5-(benzimidazol-2-ylidenemethyl)-6-oxo-2-thioxo-pyrimidin-4-olate CAS Name: 5-(2-benzimidazolylidenemethyl)-6-oxo-3-prop-2-enyl-2-sulfanylidene-4-pyrimidinolate IUPAC Name: 5-(benzimidazol-2-ylidenemethyl)-6-oxo-3-prop-2-enyl-2-sulfanylidenepyrimidin-4-olate Traditional Name: 3-allyl-5-(benzimidazol-2-ylidenemethyl)-6-keto-2-thioxo-pyrimidin-4-olate Formula: C15H11N4O2S- MolecularWeight: 311.33844

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=C(C(=O)NC1=S)C=C2N=C3C=CC=CC3=N2)[O-]

Isomeric SMILES

C=CCN1C(=C(C(=O)NC1=S)C=C2N=C3C=CC=CC3=N2)[O-]

InChI

InChI=1S/C15H12N4O2S/c1-2-7-19-14(21)9(13(20)18-15(19)22)8-12-16-10-5-3-4-6-11(10)17-12/h2-6,8,21H,1,7H2,(H,18,20,22)/p-1