[1-(4-fluorophenyl)ethenylamino] 3-[4-thiophen-2-yl-6-(trifluoromethyl)pyrimidin-2-yl]sulfonylpropanoate

Systemtic Name: [1-(4-fluorophenyl)ethenylamino] 3-[4-thiophen-2-yl-6-(trifluoromethyl)pyrimidin-2-yl]sulfonylpropanoate Openeye Name: [1-(4-fluorophenyl)vinylamino] 3-[4-(2-thienyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfonylpropanoate CAS Name: 3-[[4-thiophen-2-yl-6-(trifluoromethyl)-2-pyrimidinyl]sulfonyl]propanoic acid [1-(4-fluorophenyl)ethenylamino] ester IUPAC Name: [1-(4-fluorophenyl)ethenylamino] 3-[4-thiophen-2-yl-6-(trifluoromethyl)pyrimidin-2-yl]sulfonylpropanoate Traditional Name: 3-[4-(2-thienyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfonylpropionic acid [1-(4-fluorophenyl)vinylamino] ester Formula: C20H15F4N3O4S2 MolecularWeight: 501.474413

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Descriptors Computed from Structure

Canonical SMILES:

C=C(C1=CC=C(C=C1)F)NOC(=O)CCS(=O)(=O)C2=NC(=CC(=N2)C(F)(F)F)C3=CC=CS3

Isomeric SMILES

C=C(C1=CC=C(C=C1)F)NOC(=O)CCS(=O)(=O)C2=NC(=CC(=N2)C(F)(F)F)C3=CC=CS3

InChI

InChI=1S/C20H15F4N3O4S2/c1-12(13-4-6-14(21)7-5-13)27-31-18(28)8-10-33(29,30)19-25-15(16-3-2-9-32-16)11-17(26-19)20(22,23)24/h2-7,9,11,27H,1,8,10H2