5-methylsulfanyl-4-(3-thiophen-3-ylphenyl)sulfonyl-thiophene-2-carboximidamide; 2,2,2-tris(fluoranyl)ethanoic acid

Systemtic Name: 5-methylsulfanyl-4-(3-thiophen-3-ylphenyl)sulfonyl-thiophene-2-carboximidamide; 2,2,2-tris(fluoranyl)ethanoic acid Openeye Name: 5-methylsulfanyl-4-[3-(3-thienyl)phenyl]sulfonyl-thiophene-2-carboxamidine; 2,2,2-trifluoroacetic acid CAS Name: 5-(methylthio)-4-[3-(3-thiophenyl)phenyl]sulfonyl-2-thiophenecarboximidamide; 2,2,2-trifluoroacetic acid IUPAC Name: 5-methylsulfanyl-4-(3-thiophen-3-ylphenyl)sulfonylthiophene-2-carboximidamide; 2,2,2-trifluoroacetic acid Traditional Name: 5-(methylthio)-4-[3-(3-thienyl)phenyl]sulfonyl-thiophene-2-carboxamidine; 2,2,2-trifluoroacetic acid Formula: C18H15F3N2O4S4 MolecularWeight: 508.57791

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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=CSC=C3.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=CSC=C3.C(=O)(C(F)(F)F)O

InChI

InChI=1S/C16H14N2O2S4.C2HF3O2/c1-21-16-14(8-13(23-16)15(17)18)24(19,20)12-4-2-3-10(7-12)11-5-6-22-9-11;3-2(4,5)1(6)7/h2-9H,1H3,(H3,17,18);(H,6,7)