3-(2-nitrophenyl)-5-(7H-purin-6-ylsulfanylmethyl)-1,2,4-oxadiazole

Systemtic Name: 3-(2-nitrophenyl)-5-(7H-purin-6-ylsulfanylmethyl)-1,2,4-oxadiazole Openeye Name: 3-(2-nitrophenyl)-5-(7H-purin-6-ylsulfanylmethyl)-1,2,4-oxadiazole CAS Name: 3-(2-nitrophenyl)-5-[(7H-purin-6-ylthio)methyl]-1,2,4-oxadiazole IUPAC Name: 3-(2-nitrophenyl)-5-(7H-purin-6-ylsulfanylmethyl)-1,2,4-oxadiazole Traditional Name: 3-(2-nitrophenyl)-5-[(7H-purin-6-ylthio)methyl]-1,2,4-oxadiazole Formula: C14H9N7O3S MolecularWeight: 355.33136

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=NOC(=N2)CSC3=NC=NC4=C3NC=N4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)C2=NOC(=N2)CSC3=NC=NC4=C3NC=N4)[N+](=O)[O-]

InChI

InChI=1S/C14H9N7O3S/c22-21(23)9-4-2-1-3-8(9)12-19-10(24-20-12)5-25-14-11-13(16-6-15-11)17-7-18-14/h1-4,6-7H,5H2,(H,15,16,17,18)