3-cyclopropyl-5-[6-[4-[(1-methylimidazol-2-yl)methyl]piperazin-4-ium-1-yl]pyridin-1-ium-3-yl]-1,2,4-oxadiazole

Systemtic Name: 3-cyclopropyl-5-[6-[4-[(1-methylimidazol-2-yl)methyl]piperazin-4-ium-1-yl]pyridin-1-ium-3-yl]-1,2,4-oxadiazole Openeye Name: 3-cyclopropyl-5-[6-[4-[(1-methylimidazol-2-yl)methyl]piperazin-4-ium-1-yl]pyridin-1-ium-3-yl]-1,2,4-oxadiazole CAS Name: 3-cyclopropyl-5-[6-[4-[(1-methyl-2-imidazolyl)methyl]-1-piperazin-4-iumyl]-3-pyridin-1-iumyl]-1,2,4-oxadiazole IUPAC Name: 3-cyclopropyl-5-[6-[4-[(1-methylimidazol-2-yl)methyl]piperazin-4-ium-1-yl]pyridin-1-ium-3-yl]-1,2,4-oxadiazole Traditional Name: 3-cyclopropyl-5-[6-[4-[(1-methylimidazol-2-yl)methyl]piperazin-4-ium-1-yl]pyridin-1-ium-3-yl]-1,2,4-oxadiazole Formula: C19H25N7O+2 MolecularWeight: 367.4481

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1C[NH+]2CCN(CC2)C3=[NH+]C=C(C=C3)C4=NC(=NO4)C5CC5

Isomeric SMILES

CN1C=CN=C1C[NH+]2CCN(CC2)C3=[NH+]C=C(C=C3)C4=NC(=NO4)C5CC5

InChI

InChI=1S/C19H23N7O/c1-24-7-6-20-17(24)13-25-8-10-26(11-9-25)16-5-4-15(12-21-16)19-22-18(23-27-19)14-2-3-14/h4-7,12,14H,2-3,8-11,13H2,1H3/p+2