4-ethyl-3-(3-methyl-5-nitro-imidazol-4-yl)sulfanyl-5-(2-methylphenyl)-1,2,4-triazole

Systemtic Name: 4-ethyl-3-(3-methyl-5-nitro-imidazol-4-yl)sulfanyl-5-(2-methylphenyl)-1,2,4-triazole Openeye Name: 4-ethyl-3-(3-methyl-5-nitro-imidazol-4-yl)sulfanyl-5-(o-tolyl)-1,2,4-triazole CAS Name: 4-ethyl-3-[(3-methyl-5-nitro-4-imidazolyl)thio]-5-(2-methylphenyl)-1,2,4-triazole IUPAC Name: 4-ethyl-3-(3-methyl-5-nitroimidazol-4-yl)sulfanyl-5-(2-methylphenyl)-1,2,4-triazole Traditional Name: 4-ethyl-3-[(3-methyl-5-nitro-imidazol-4-yl)thio]-5-(o-tolyl)-1,2,4-triazole Formula: C15H16N6O2S MolecularWeight: 344.39154

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SC2=C(N=CN2C)[N+](=O)[O-])C3=CC=CC=C3C

Isomeric SMILES

CCN1C(=NN=C1SC2=C(N=CN2C)[N+](=O)[O-])C3=CC=CC=C3C

InChI

InChI=1S/C15H16N6O2S/c1-4-20-12(11-8-6-5-7-10(11)2)17-18-15(20)24-14-13(21(22)23)16-9-19(14)3/h5-9H,4H2,1-3H3