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

Systemtic Name: 3-(3-ethyl-2-methyl-5-nitro-imidazol-4-yl)sulfanyl-4-methyl-1,2,4-triazole Openeye Name: 3-(3-ethyl-2-methyl-5-nitro-imidazol-4-yl)sulfanyl-4-methyl-1,2,4-triazole CAS Name: 3-[(3-ethyl-2-methyl-5-nitro-4-imidazolyl)thio]-4-methyl-1,2,4-triazole IUPAC Name: 3-(3-ethyl-2-methyl-5-nitroimidazol-4-yl)sulfanyl-4-methyl-1,2,4-triazole Traditional Name: 3-[(3-ethyl-2-methyl-5-nitro-imidazol-4-yl)thio]-4-methyl-1,2,4-triazole Formula: C9H12N6O2S MolecularWeight: 268.29558

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NC(=C1SC2=NN=CN2C)[N+](=O)[O-])C

Isomeric SMILES

CCN1C(=NC(=C1SC2=NN=CN2C)[N+](=O)[O-])C

InChI

InChI=1S/C9H12N6O2S/c1-4-14-6(2)11-7(15(16)17)8(14)18-9-12-10-5-13(9)3/h5H,4H2,1-3H3