(5Z)-5-(1H-benzimidazol-2-ylmethylidene)-1-hexyl-4,6-bis(oxidanylidene)pyrimidin-2-olate

Systemtic Name: (5Z)-5-(1H-benzimidazol-2-ylmethylidene)-1-hexyl-4,6-bis(oxidanylidene)pyrimidin-2-olate Openeye Name: (5Z)-5-(1H-benzimidazol-2-ylmethylene)-1-hexyl-4,6-dioxo-pyrimidin-2-olate CAS Name: (5Z)-5-(1H-benzimidazol-2-ylmethylidene)-1-hexyl-4,6-dioxo-2-pyrimidinolate IUPAC Name: (5Z)-5-(1H-benzimidazol-2-ylmethylidene)-1-hexyl-4,6-dioxopyrimidin-2-olate Traditional Name: (5Z)-5-(1H-benzimidazol-2-ylmethylene)-1-hexyl-4,6-diketo-pyrimidin-2-olate Formula: C18H19N4O3- MolecularWeight: 339.36846

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=O)C(=CC2=NC3=CC=CC=C3N2)C(=O)N=C1[O-]

Isomeric SMILES

CCCCCCN1C(=O)/C(=C\C2=NC3=CC=CC=C3N2)/C(=O)N=C1[O-]

InChI

InChI=1S/C18H20N4O3/c1-2-3-4-7-10-22-17(24)12(16(23)21-18(22)25)11-15-19-13-8-5-6-9-14(13)20-15/h5-6,8-9,11H,2-4,7,10H2,1H3,(H,19,20)(H,21,23,25)/p-1/b12-11-