2-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]pyrimido[1,2-a]benzimidazol-4-olate

Systemtic Name: 2-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]pyrimido[1,2-a]benzimidazol-4-olate Openeye Name: 2-[(1-methyltetrazol-5-yl)sulfanylmethyl]pyrimido[1,2-a]benzimidazol-4-olate CAS Name: 2-[[(1-methyl-5-tetrazolyl)thio]methyl]-4-pyrimido[1,2-a]benzimidazololate IUPAC Name: 2-[(1-methyltetrazol-5-yl)sulfanylmethyl]pyrimido[1,2-a]benzimidazol-4-olate Traditional Name: 2-[[(1-methyltetrazol-5-yl)thio]methyl]pyrimido[1,2-a]benzimidazol-4-olate Formula: C13H10N7OS- MolecularWeight: 312.3298

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=N1)SCC2=NC3=NC4=CC=CC=C4N3C(=C2)[O-]

Isomeric SMILES

CN1C(=NN=N1)SCC2=NC3=NC4=CC=CC=C4N3C(=C2)[O-]

InChI

InChI=1S/C13H11N7OS/c1-19-13(16-17-18-19)22-7-8-6-11(21)20-10-5-3-2-4-9(10)15-12(20)14-8/h2-6,21H,7H2,1H3/p-1