5-(3-methylbutyl)-1H-1,2,4-triazole-3-sulfonyl fluoride

Systemtic Name: 5-(3-methylbutyl)-1H-1,2,4-triazole-3-sulfonyl fluoride Openeye Name: 5-isopentyl-1H-1,2,4-triazole-3-sulfonyl fluoride CAS Name: 5-(3-methylbutyl)-1H-1,2,4-triazole-3-sulfonyl fluoride IUPAC Name: 5-(3-methylbutyl)-1H-1,2,4-triazole-3-sulfonyl fluoride Traditional Name: 5-isoamyl-1H-1,2,4-triazole-3-sulfonyl fluoride Formula: C7H12FN3O2S MolecularWeight: 221.252483

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC1=NC(=NN1)S(=O)(=O)F

Isomeric SMILES

CC(C)CCC1=NC(=NN1)S(=O)(=O)F

InChI

InChI=1S/C7H12FN3O2S/c1-5(2)3-4-6-9-7(11-10-6)14(8,12)13/h5H,3-4H2,1-2H3,(H,9,10,11)