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

Systemtic Name: 2-[4-(furan-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-N-(3-methoxy-5-nitro-phenyl)ethanamide Openeye Name: 2-[4-(2-furyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-N-(3-methoxy-5-nitro-phenyl)acetamide CAS Name: 2-[[4-(2-furanyl)-6-(trifluoromethyl)-2-pyrimidinyl]thio]-N-(3-methoxy-5-nitrophenyl)acetamide IUPAC Name: 2-[4-(furan-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-N-(3-methoxy-5-nitrophenyl)acetamide Traditional Name: 2-[[4-(2-furyl)-6-(trifluoromethyl)pyrimidin-2-yl]thio]-N-(3-methoxy-5-nitro-phenyl)acetamide Formula: C18H13F3N4O5S MolecularWeight: 454.37983

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)[N+](=O)[O-])NC(=O)CSC2=NC(=CC(=N2)C(F)(F)F)C3=CC=CO3

Isomeric SMILES

COC1=CC(=CC(=C1)[N+](=O)[O-])NC(=O)CSC2=NC(=CC(=N2)C(F)(F)F)C3=CC=CO3

InChI

InChI=1S/C18H13F3N4O5S/c1-29-12-6-10(5-11(7-12)25(27)28)22-16(26)9-31-17-23-13(14-3-2-4-30-14)8-15(24-17)18(19,20)21/h2-8H,9H2,1H3,(H,22,26)