6-[(2-methyl-5-nitro-1H-imidazol-4-yl)sulfanyl]-7H-purine

Systemtic Name: 6-[(2-methyl-5-nitro-1H-imidazol-4-yl)sulfanyl]-7H-purine Openeye Name: 6-[(2-methyl-5-nitro-1H-imidazol-4-yl)sulfanyl]-7H-purine CAS Name: 6-[(2-methyl-5-nitro-1H-imidazol-4-yl)thio]-7H-purine IUPAC Name: 6-[(2-methyl-5-nitro-1H-imidazol-4-yl)sulfanyl]-7H-purine Traditional Name: 6-[(2-methyl-5-nitro-1H-imidazol-4-yl)thio]-7H-purine Formula: C9H7N7O2S MolecularWeight: 277.26258

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(N1)[N+](=O)[O-])SC2=NC=NC3=C2NC=N3

Isomeric SMILES

CC1=NC(=C(N1)[N+](=O)[O-])SC2=NC=NC3=C2NC=N3

InChI

InChI=1S/C9H7N7O2S/c1-4-14-7(16(17)18)9(15-4)19-8-5-6(11-2-10-5)12-3-13-8/h2-3H,1H3,(H,14,15)(H,10,11,12,13)