2-(4-imidazol-1-ylphenyl)-4H-1,3,4-oxadiazin-5-one

Systemtic Name: 2-(4-imidazol-1-ylphenyl)-4H-1,3,4-oxadiazin-5-one Openeye Name: 2-(4-imidazol-1-ylphenyl)-4H-1,3,4-oxadiazin-5-one CAS Name: 2-[4-(1-imidazolyl)phenyl]-4H-1,3,4-oxadiazin-5-one IUPAC Name: 2-(4-imidazol-1-ylphenyl)-4H-1,3,4-oxadiazin-5-one Traditional Name: 2-(4-imidazol-1-ylphenyl)-4H-1,3,4-oxadiazin-5-one Formula: C12H10N4O2 MolecularWeight: 242.2334

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)NN=C(O1)C2=CC=C(C=C2)N3C=CN=C3

Isomeric SMILES

C1C(=O)NN=C(O1)C2=CC=C(C=C2)N3C=CN=C3

InChI

InChI=1S/C12H10N4O2/c17-11-7-18-12(15-14-11)9-1-3-10(4-2-9)16-6-5-13-8-16/h1-6,8H,7H2,(H,14,17)