6-[2-(1H-benzimidazol-2-yl)ethylcarbamoyl]-4-oxidanylidene-1H-pyrimidin-2-olate

Systemtic Name: 6-[2-(1H-benzimidazol-2-yl)ethylcarbamoyl]-4-oxidanylidene-1H-pyrimidin-2-olate Openeye Name: 6-[2-(1H-benzimidazol-2-yl)ethylcarbamoyl]-4-oxo-1H-pyrimidin-2-olate CAS Name: 6-[[2-(1H-benzimidazol-2-yl)ethylamino]-oxomethyl]-4-oxo-1H-pyrimidin-2-olate IUPAC Name: 6-[2-(1H-benzimidazol-2-yl)ethylcarbamoyl]-4-oxo-1H-pyrimidin-2-olate Traditional Name: 6-[2-(1H-benzimidazol-2-yl)ethylcarbamoyl]-4-keto-1H-pyrimidin-2-olate Formula: C14H12N5O3- MolecularWeight: 298.27678

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)CCNC(=O)C3=CC(=O)N=C(N3)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)CCNC(=O)C3=CC(=O)N=C(N3)[O-]

InChI

InChI=1S/C14H13N5O3/c20-12-7-10(18-14(22)19-12)13(21)15-6-5-11-16-8-3-1-2-4-9(8)17-11/h1-4,7H,5-6H2,(H,15,21)(H,16,17)(H2,18,19,20,22)/p-1