6-iodanyl-5-methyl-2-phenyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one

Systemtic Name: 6-iodanyl-5-methyl-2-phenyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one Openeye Name: 6-iodo-5-methyl-2-phenyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one CAS Name: 6-iodo-5-methyl-2-phenyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one IUPAC Name: 6-iodo-5-methyl-2-phenyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one Traditional Name: 6-iodo-5-methyl-2-phenyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one Formula: C12H9IN4O MolecularWeight: 352.13053

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N2C(=N1)N=C(N2)C3=CC=CC=C3)I

Isomeric SMILES

CC1=C(C(=O)N2C(=N1)N=C(N2)C3=CC=CC=C3)I

InChI

InChI=1S/C12H9IN4O/c1-7-9(13)11(18)17-12(14-7)15-10(16-17)8-5-3-2-4-6-8/h2-6H,1H3,(H,14,15,16)