N-[3-(4-fluoranylphenoxy)-5-nitro-phenyl]-2-[4-thiophen-2-yl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-[3-(4-fluoranylphenoxy)-5-nitro-phenyl]-2-[4-thiophen-2-yl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-ethanamide Openeye Name: N-[3-(4-fluorophenoxy)-5-nitro-phenyl]-2-[4-(2-thienyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-acetamide CAS Name: N-[3-(4-fluorophenoxy)-5-nitrophenyl]-2-[[4-thiophen-2-yl-6-(trifluoromethyl)-2-pyrimidinyl]thio]acetamide IUPAC Name: N-[3-(4-fluorophenoxy)-5-nitrophenyl]-2-[4-thiophen-2-yl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylacetamide Traditional Name: N-[3-(4-fluorophenoxy)-5-nitro-phenyl]-2-[[4-(2-thienyl)-6-(trifluoromethyl)pyrimidin-2-yl]thio]acetamide Formula: C23H14F4N4O4S2 MolecularWeight: 550.505273

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C2=CC(=NC(=N2)SCC(=O)NC3=CC(=CC(=C3)OC4=CC=C(C=C4)F)[N+](=O)[O-])C(F)(F)F

Isomeric SMILES

C1=CSC(=C1)C2=CC(=NC(=N2)SCC(=O)NC3=CC(=CC(=C3)OC4=CC=C(C=C4)F)[N+](=O)[O-])C(F)(F)F

InChI

InChI=1S/C23H14F4N4O4S2/c24-13-3-5-16(6-4-13)35-17-9-14(8-15(10-17)31(33)34)28-21(32)12-37-22-29-18(19-2-1-7-36-19)11-20(30-22)23(25,26)27/h1-11H,12H2,(H,28,32)