3-methyl-5-oxidanylidene-7-pyridin-4-yl-1H-[1,2,4]triazolo[4,3-a]pyrimidine-6-carbonitrile

Systemtic Name: 3-methyl-5-oxidanylidene-7-pyridin-4-yl-1H-[1,2,4]triazolo[4,3-a]pyrimidine-6-carbonitrile Openeye Name: 3-methyl-5-oxo-7-(4-pyridyl)-1H-[1,2,4]triazolo[4,3-a]pyrimidine-6-carbonitrile CAS Name: 3-methyl-5-oxo-7-pyridin-4-yl-1H-[1,2,4]triazolo[4,3-a]pyrimidine-6-carbonitrile IUPAC Name: 3-methyl-5-oxo-7-pyridin-4-yl-1H-[1,2,4]triazolo[4,3-a]pyrimidine-6-carbonitrile Traditional Name: 5-keto-3-methyl-7-(4-pyridyl)-1H-[1,2,4]triazolo[4,3-a]pyrimidine-6-carbonitrile Formula: C12H8N6O MolecularWeight: 252.23152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NNC2=NC(=C(C(=O)N12)C#N)C3=CC=NC=C3

Isomeric SMILES

CC1=NNC2=NC(=C(C(=O)N12)C#N)C3=CC=NC=C3

InChI

InChI=1S/C12H8N6O/c1-7-16-17-12-15-10(8-2-4-14-5-3-8)9(6-13)11(19)18(7)12/h2-5H,1H3,(H,15,17)