N7-(furan-2-ylmethyl)-4-nitro-N7-(oxolan-2-ylmethyl)-N5-pyridin-2-yl-2,1,3-benzoxadiazole-5,7-diamine

Systemtic Name: N7-(furan-2-ylmethyl)-4-nitro-N7-(oxolan-2-ylmethyl)-N5-pyridin-2-yl-2,1,3-benzoxadiazole-5,7-diamine Openeye Name: N7-(2-furylmethyl)-4-nitro-N5-(2-pyridyl)-N7-(tetrahydrofuran-2-ylmethyl)-2,1,3-benzoxadiazole-5,7-diamine CAS Name: N7-(2-furanylmethyl)-4-nitro-N7-(2-oxolanylmethyl)-N5-(2-pyridinyl)-2,1,3-benzoxadiazole-5,7-diamine IUPAC Name: 7-N-(furan-2-ylmethyl)-4-nitro-7-N-(oxolan-2-ylmethyl)-5-N-pyridin-2-yl-2,1,3-benzoxadiazole-5,7-diamine Traditional Name: 2-furfuryl-[7-nitro-6-(2-pyridylamino)benzofurazan-4-yl]-(tetrahydrofurfuryl)amine Formula: C21H20N6O5 MolecularWeight: 436.4207

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CN(CC2=CC=CO2)C3=CC(=C(C4=NON=C34)[N+](=O)[O-])NC5=CC=CC=N5

Isomeric SMILES

C1CC(OC1)CN(CC2=CC=CO2)C3=CC(=C(C4=NON=C34)[N+](=O)[O-])NC5=CC=CC=N5

InChI

InChI=1S/C21H20N6O5/c28-27(29)21-16(23-18-7-1-2-8-22-18)11-17(19-20(21)25-32-24-19)26(12-14-5-3-9-30-14)13-15-6-4-10-31-15/h1-3,5,7-9,11,15H,4,6,10,12-13H2,(H,22,23)