3-(furan-2-yl)-5-[(3-nitrophenyl)methylsulfanyl]-4-(4-phenylmethoxyphenyl)-1,2,4-triazole

Systemtic Name: 3-(furan-2-yl)-5-[(3-nitrophenyl)methylsulfanyl]-4-(4-phenylmethoxyphenyl)-1,2,4-triazole Openeye Name: 4-(4-benzyloxyphenyl)-3-(2-furyl)-5-[(3-nitrophenyl)methylsulfanyl]-1,2,4-triazole CAS Name: 3-(2-furanyl)-5-[(3-nitrophenyl)methylthio]-4-(4-phenylmethoxyphenyl)-1,2,4-triazole IUPAC Name: 3-(furan-2-yl)-5-[(3-nitrophenyl)methylsulfanyl]-4-(4-phenylmethoxyphenyl)-1,2,4-triazole Traditional Name: 4-(4-benzoxyphenyl)-3-(2-furyl)-5-[(3-nitrobenzyl)thio]-1,2,4-triazole Formula: C26H20N4O4S MolecularWeight: 484.5264

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=C(C=C2)N3C(=NN=C3SCC4=CC(=CC=C4)[N+](=O)[O-])C5=CC=CO5

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)N3C(=NN=C3SCC4=CC(=CC=C4)[N+](=O)[O-])C5=CC=CO5

InChI

InChI=1S/C26H20N4O4S/c31-30(32)22-9-4-8-20(16-22)18-35-26-28-27-25(24-10-5-15-33-24)29(26)21-11-13-23(14-12-21)34-17-19-6-2-1-3-7-19/h1-16H,17-18H2