4-[3-(4-methanoylphenyl)phenyl]sulfonyl-5-methylsulfanyl-thiophene-2-carboximidamide; 2,2,2-tris(fluoranyl)ethanoic acid

Systemtic Name: 4-[3-(4-methanoylphenyl)phenyl]sulfonyl-5-methylsulfanyl-thiophene-2-carboximidamide; 2,2,2-tris(fluoranyl)ethanoic acid Openeye Name: 4-[3-(4-formylphenyl)phenyl]sulfonyl-5-methylsulfanyl-thiophene-2-carboxamidine; 2,2,2-trifluoroacetic acid CAS Name: 4-[3-(4-formylphenyl)phenyl]sulfonyl-5-(methylthio)-2-thiophenecarboximidamide; 2,2,2-trifluoroacetic acid IUPAC Name: 4-[3-(4-formylphenyl)phenyl]sulfonyl-5-methylsulfanylthiophene-2-carboximidamide; 2,2,2-trifluoroacetic acid Traditional Name: 4-[3-(4-formylphenyl)phenyl]sulfonyl-5-(methylthio)thiophene-2-carboxamidine; 2,2,2-trifluoroacetic acid Formula: C21H17F3N2O5S3 MolecularWeight: 530.56029

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=C(S1)C(=N)N)S(=O)(=O)C2=CC=CC(=C2)C3=CC=C(C=C3)C=O.C(=O)(C(F)(F)F)O

Isomeric SMILES

CSC1=C(C=C(S1)C(=N)N)S(=O)(=O)C2=CC=CC(=C2)C3=CC=C(C=C3)C=O.C(=O)(C(F)(F)F)O

InChI

InChI=1S/C19H16N2O3S3.C2HF3O2/c1-25-19-17(10-16(26-19)18(20)21)27(23,24)15-4-2-3-14(9-15)13-7-5-12(11-22)6-8-13;3-2(4,5)1(6)7/h2-11H,1H3,(H3,20,21);(H,6,7)