N-(3-imidazol-1-ylpropyl)-5-oxidanidyl-4-pyridin-3-yl-1,2,5-oxadiazol-5-ium-3-carboxamide

Systemtic Name: N-(3-imidazol-1-ylpropyl)-5-oxidanidyl-4-pyridin-3-yl-1,2,5-oxadiazol-5-ium-3-carboxamide Openeye Name: N-(3-imidazol-1-ylpropyl)-5-oxido-4-(3-pyridyl)-1,2,5-oxadiazol-5-ium-3-carboxamide CAS Name: N-[3-(1-imidazolyl)propyl]-5-oxido-4-(3-pyridinyl)-1,2,5-oxadiazol-5-ium-3-carboxamide IUPAC Name: N-(3-imidazol-1-ylpropyl)-5-oxido-4-pyridin-3-yl-1,2,5-oxadiazol-5-ium-3-carboxamide Traditional Name: N-(3-imidazol-1-ylpropyl)-5-oxido-4-(3-pyridyl)furazan-5-ium-3-carboxamide Formula: C14H14N6O3 MolecularWeight: 314.29936

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C2=[N+](ON=C2C(=O)NCCCN3C=CN=C3)[O-]

Isomeric SMILES

C1=CC(=CN=C1)C2=[N+](ON=C2C(=O)NCCCN3C=CN=C3)[O-]

InChI

InChI=1S/C14H14N6O3/c21-14(17-5-2-7-19-8-6-16-10-19)12-13(20(22)23-18-12)11-3-1-4-15-9-11/h1,3-4,6,8-10H,2,5,7H2,(H,17,21)