5-[[1-(2-methylphenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-2-nitro-pyridine

Systemtic Name: 5-[[1-(2-methylphenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-2-nitro-pyridine Openeye Name: 2-nitro-5-[1-(o-tolyl)tetrazol-5-yl]sulfanyl-pyridine CAS Name: 5-[[1-(2-methylphenyl)-5-tetrazolyl]thio]-2-nitropyridine IUPAC Name: 5-[1-(2-methylphenyl)tetrazol-5-yl]sulfanyl-2-nitropyridine Traditional Name: 2-nitro-5-[[1-(o-tolyl)tetrazol-5-yl]thio]pyridine Formula: C13H10N6O2S MolecularWeight: 314.3225

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=NN=N2)SC3=CN=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1N2C(=NN=N2)SC3=CN=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C13H10N6O2S/c1-9-4-2-3-5-11(9)18-13(15-16-17-18)22-10-6-7-12(14-8-10)19(20)21/h2-8H,1H3