1,5,7-trimethyl-2H-[1,2,4]triazolo[4,3-a]pyrimidin-4-ium-3-one

Systemtic Name: 1,5,7-trimethyl-2H-[1,2,4]triazolo[4,3-a]pyrimidin-4-ium-3-one Openeye Name: 1,5,7-trimethyl-2H-[1,2,4]triazolo[4,3-a]pyrimidin-4-ium-3-one CAS Name: 1,5,7-trimethyl-2H-[1,2,4]triazolo[4,3-a]pyrimidin-4-ium-3-one IUPAC Name: 1,5,7-trimethyl-2H-[1,2,4]triazolo[4,3-a]pyrimidin-4-ium-3-one Traditional Name: 1,5,7-trimethyl-2H-[1,2,4]triazolo[4,3-a]pyrimidin-4-ium-3-one Formula: C8H11N4O+ MolecularWeight: 179.19914

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[N+]2C(=O)NN(C2=N1)C)C

Isomeric SMILES

CC1=CC(=[N+]2C(=O)NN(C2=N1)C)C

InChI

InChI=1S/C8H10N4O/c1-5-4-6(2)12-7(9-5)11(3)10-8(12)13/h4H,1-3H3/p+1