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

Systemtic Name: 5-ethyl-3-(3-methyl-5-nitro-imidazol-4-yl)sulfanyl-1H-1,2,4-triazole Openeye Name: 5-ethyl-3-(3-methyl-5-nitro-imidazol-4-yl)sulfanyl-1H-1,2,4-triazole CAS Name: 5-ethyl-3-[(3-methyl-5-nitro-4-imidazolyl)thio]-1H-1,2,4-triazole IUPAC Name: 5-ethyl-3-(3-methyl-5-nitroimidazol-4-yl)sulfanyl-1H-1,2,4-triazole Traditional Name: 5-ethyl-3-[(3-methyl-5-nitro-imidazol-4-yl)thio]-1H-1,2,4-triazole Formula: C8H10N6O2S MolecularWeight: 254.269

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=NN1)SC2=C(N=CN2C)[N+](=O)[O-]

Isomeric SMILES

CCC1=NC(=NN1)SC2=C(N=CN2C)[N+](=O)[O-]

InChI

InChI=1S/C8H10N6O2S/c1-3-5-10-8(12-11-5)17-7-6(14(15)16)9-4-13(7)2/h4H,3H2,1-2H3,(H,10,11,12)