3-methylsulfanyl-5-(5-nitrofuran-2-yl)-1H-1,2,4-triazole

Systemtic Name: 3-methylsulfanyl-5-(5-nitrofuran-2-yl)-1H-1,2,4-triazole Openeye Name: 3-methylsulfanyl-5-(5-nitro-2-furyl)-1H-1,2,4-triazole CAS Name: 3-(methylthio)-5-(5-nitro-2-furanyl)-1H-1,2,4-triazole IUPAC Name: 3-methylsulfanyl-5-(5-nitrofuran-2-yl)-1H-1,2,4-triazole Traditional Name: 3-(methylthio)-5-(5-nitro-2-furyl)-1H-1,2,4-triazole Formula: C7H6N4O3S MolecularWeight: 226.21254

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NNC(=N1)C2=CC=C(O2)[N+](=O)[O-]

Isomeric SMILES

CSC1=NNC(=N1)C2=CC=C(O2)[N+](=O)[O-]

InChI

InChI=1S/C7H6N4O3S/c1-15-7-8-6(9-10-7)4-2-3-5(14-4)11(12)13/h2-3H,1H3,(H,8,9,10)