5-bromanyl-4-(2-methoxyphenyl)sulfonyl-thiophene-2-carboximidamide; 2,2,2-tris(fluoranyl)ethanoic acid

Systemtic Name: 5-bromanyl-4-(2-methoxyphenyl)sulfonyl-thiophene-2-carboximidamide; 2,2,2-tris(fluoranyl)ethanoic acid Openeye Name: 5-bromo-4-(2-methoxyphenyl)sulfonyl-thiophene-2-carboxamidine; 2,2,2-trifluoroacetic acid CAS Name: 5-bromo-4-(2-methoxyphenyl)sulfonyl-2-thiophenecarboximidamide; 2,2,2-trifluoroacetic acid IUPAC Name: 5-bromo-4-(2-methoxyphenyl)sulfonylthiophene-2-carboximidamide; 2,2,2-trifluoroacetic acid Traditional Name: 5-bromo-4-(2-methoxyphenyl)sulfonyl-thiophene-2-carboxamidine; 2,2,2-trifluoroacetic acid Formula: C14H12BrF3N2O5S2 MolecularWeight: 489.28469

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1S(=O)(=O)C2=C(SC(=C2)C(=N)N)Br.C(=O)(C(F)(F)F)O

Isomeric SMILES

COC1=CC=CC=C1S(=O)(=O)C2=C(SC(=C2)C(=N)N)Br.C(=O)(C(F)(F)F)O

InChI

InChI=1S/C12H11BrN2O3S2.C2HF3O2/c1-18-7-4-2-3-5-9(7)20(16,17)10-6-8(12(14)15)19-11(10)13;3-2(4,5)1(6)7/h2-6H,1H3,(H3,14,15);(H,6,7)