3-[[2,5-bis(chloranyl)-4-[[6-(4-nitrophenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl]methoxy]phenoxy]methyl]-6-(4-nitrophenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole

Systemtic Name: 3-[[2,5-bis(chloranyl)-4-[[6-(4-nitrophenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl]methoxy]phenoxy]methyl]-6-(4-nitrophenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole Openeye Name: 3-[[2,5-dichloro-4-[[6-(4-nitrophenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl]methoxy]phenoxy]methyl]-6-(4-nitrophenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole CAS Name: 3-[[2,5-dichloro-4-[[6-(4-nitrophenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl]methoxy]phenoxy]methyl]-6-(4-nitrophenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole IUPAC Name: 3-[[2,5-dichloro-4-[[6-(4-nitrophenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl]methoxy]phenoxy]methyl]-6-(4-nitrophenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole Traditional Name: 3-[[2,5-dichloro-4-[[6-(4-nitrophenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl]methoxy]phenoxy]methyl]-6-(4-nitrophenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole Formula: C26H14Cl2N10O6S2 MolecularWeight: 697.48876

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NN3C(=NN=C3S2)COC4=CC(=C(C=C4Cl)OCC5=NN=C6N5N=C(S6)C7=CC=C(C=C7)[N+](=O)[O-])Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C2=NN3C(=NN=C3S2)COC4=CC(=C(C=C4Cl)OCC5=NN=C6N5N=C(S6)C7=CC=C(C=C7)[N+](=O)[O-])Cl)[N+](=O)[O-]

InChI

InChI=1S/C26H14Cl2N10O6S2/c27-17-10-20(44-12-22-30-32-26-36(22)34-24(46-26)14-3-7-16(8-4-14)38(41)42)18(28)9-19(17)43-11-21-29-31-25-35(21)33-23(45-25)13-1-5-15(6-2-13)37(39)40/h1-10H,11-12H2