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

Systemtic Name: 2-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]-1H-pyrimido[1,2-a]benzimidazol-4-one Openeye Name: 2-[(1-methyltetrazol-5-yl)sulfanylmethyl]-1H-pyrimido[1,2-a]benzimidazol-4-one CAS Name: 2-[[(1-methyl-5-tetrazolyl)thio]methyl]-1H-pyrimido[1,2-a]benzimidazol-4-one IUPAC Name: 2-[(1-methyltetrazol-5-yl)sulfanylmethyl]-1H-pyrimido[1,2-a]benzimidazol-4-one Traditional Name: 2-[[(1-methyltetrazol-5-yl)thio]methyl]-1H-pyrimido[1,2-a]benzimidazol-4-one Formula: C13H11N7OS MolecularWeight: 313.33774

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=N1)SCC2=CC(=O)N3C4=CC=CC=C4N=C3N2

Isomeric SMILES

CN1C(=NN=N1)SCC2=CC(=O)N3C4=CC=CC=C4N=C3N2

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/h2-6H,7H2,1H3,(H,14,15)