6-(1,2,4-triazol-1-yl)-1H-pyrimidin-2-one

Systemtic Name: 6-(1,2,4-triazol-1-yl)-1H-pyrimidin-2-one Openeye Name: 6-(1,2,4-triazol-1-yl)-1H-pyrimidin-2-one CAS Name: 6-(1,2,4-triazol-1-yl)-1H-pyrimidin-2-one IUPAC Name: 6-(1,2,4-triazol-1-yl)-1H-pyrimidin-2-one Traditional Name: 6-(1,2,4-triazol-1-yl)-1H-pyrimidin-2-one Formula: C6H5N5O MolecularWeight: 163.1368

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=C(NC(=O)N=C1)N2C=NC=N2

Isomeric SMILES

C1=C(NC(=O)N=C1)N2C=NC=N2

InChI

InChI=1S/C6H5N5O/c12-6-8-2-1-5(10-6)11-4-7-3-9-11/h1-4H,(H,8,10,12)