5-[4-(4-methylpiperazin-1-yl)-3-nitro-phenyl]-3-pyridin-2-yl-1,2,4-oxadiazole

Systemtic Name: 5-[4-(4-methylpiperazin-1-yl)-3-nitro-phenyl]-3-pyridin-2-yl-1,2,4-oxadiazole Openeye Name: 5-[4-(4-methylpiperazin-1-yl)-3-nitro-phenyl]-3-(2-pyridyl)-1,2,4-oxadiazole CAS Name: 5-[4-(4-methyl-1-piperazinyl)-3-nitrophenyl]-3-(2-pyridinyl)-1,2,4-oxadiazole IUPAC Name: 5-[4-(4-methylpiperazin-1-yl)-3-nitrophenyl]-3-pyridin-2-yl-1,2,4-oxadiazole Traditional Name: 5-[4-(4-methylpiperazino)-3-nitro-phenyl]-3-(2-pyridyl)-1,2,4-oxadiazole Formula: C18H18N6O3 MolecularWeight: 366.37392

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(C=C(C=C2)C3=NC(=NO3)C4=CC=CC=N4)[N+](=O)[O-]

Isomeric SMILES

CN1CCN(CC1)C2=C(C=C(C=C2)C3=NC(=NO3)C4=CC=CC=N4)[N+](=O)[O-]

InChI

InChI=1S/C18H18N6O3/c1-22-8-10-23(11-9-22)15-6-5-13(12-16(15)24(25)26)18-20-17(21-27-18)14-4-2-3-7-19-14/h2-7,12H,8-11H2,1H3