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

Systemtic Name: 5-methylsulfanyl-4-(3-pyridin-3-ylphenyl)sulfonyl-thiophene-2-carboximidamide; 2,2,2-tris(fluoranyl)ethanoic acid Openeye Name: 5-methylsulfanyl-4-[3-(3-pyridyl)phenyl]sulfonyl-thiophene-2-carboxamidine; 2,2,2-trifluoroacetic acid CAS Name: 5-(methylthio)-4-[3-(3-pyridinyl)phenyl]sulfonyl-2-thiophenecarboximidamide; 2,2,2-trifluoroacetic acid IUPAC Name: 5-methylsulfanyl-4-(3-pyridin-3-ylphenyl)sulfonylthiophene-2-carboximidamide; 2,2,2-trifluoroacetic acid Traditional Name: 5-(methylthio)-4-[3-(3-pyridyl)phenyl]sulfonyl-thiophene-2-carboxamidine; 2,2,2-trifluoroacetic acid Formula: C19H16F3N3O4S3 MolecularWeight: 503.53825

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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=CN=CC=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=CN=CC=C3.C(=O)(C(F)(F)F)O

InChI

InChI=1S/C17H15N3O2S3.C2HF3O2/c1-23-17-15(9-14(24-17)16(18)19)25(21,22)13-6-2-4-11(8-13)12-5-3-7-20-10-12;3-2(4,5)1(6)7/h2-10H,1H3,(H3,18,19);(H,6,7)