4-(4-bromanylpyrazol-1-yl)-1,2-dihydropyrazol-3-one

Systemtic Name: 4-(4-bromanylpyrazol-1-yl)-1,2-dihydropyrazol-3-one Openeye Name: 4-(4-bromopyrazol-1-yl)-1,2-dihydropyrazol-3-one CAS Name: 4-(4-bromo-1-pyrazolyl)-1,2-dihydropyrazol-3-one IUPAC Name: 4-(4-bromopyrazol-1-yl)-1,2-dihydropyrazol-3-one Traditional Name: 4-(4-bromopyrazol-1-yl)-3-pyrazolin-3-one Formula: C6H5BrN4O MolecularWeight: 229.0341

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=O)NN1)N2C=C(C=N2)Br

Isomeric SMILES

C1=C(C(=O)NN1)N2C=C(C=N2)Br

InChI

InChI=1S/C6H5BrN4O/c7-4-1-9-11(3-4)5-2-8-10-6(5)12/h1-3H,(H2,8,10,12)