5-methyl-6-nitro-2-pyridin-4-yl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one

Systemtic Name: 5-methyl-6-nitro-2-pyridin-4-yl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one Openeye Name: 5-methyl-6-nitro-2-(4-pyridyl)-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one CAS Name: 5-methyl-6-nitro-2-pyridin-4-yl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one IUPAC Name: 5-methyl-6-nitro-2-pyridin-4-yl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one Traditional Name: 5-methyl-6-nitro-2-(4-pyridyl)-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one Formula: C11H8N6O3 MolecularWeight: 272.21962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N2C(=N1)N=C(N2)C3=CC=NC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=O)N2C(=N1)N=C(N2)C3=CC=NC=C3)[N+](=O)[O-]

InChI

InChI=1S/C11H8N6O3/c1-6-8(17(19)20)10(18)16-11(13-6)14-9(15-16)7-2-4-12-5-3-7/h2-5H,1H3,(H,13,14,15)