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

Systemtic Name: N-(4-methoxy-2-nitro-phenyl)-2-[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-ethanamide Openeye Name: N-(4-methoxy-2-nitro-phenyl)-2-[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-acetamide CAS Name: N-(4-methoxy-2-nitrophenyl)-2-[[4-methyl-6-(trifluoromethyl)-2-pyrimidinyl]thio]acetamide IUPAC Name: N-(4-methoxy-2-nitrophenyl)-2-[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylacetamide Traditional Name: N-(4-methoxy-2-nitro-phenyl)-2-[[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]thio]acetamide Formula: C15H13F3N4O4S MolecularWeight: 402.34833

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(=O)NC2=C(C=C(C=C2)OC)[N+](=O)[O-])C(F)(F)F

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(=O)NC2=C(C=C(C=C2)OC)[N+](=O)[O-])C(F)(F)F

InChI

InChI=1S/C15H13F3N4O4S/c1-8-5-12(15(16,17)18)21-14(19-8)27-7-13(23)20-10-4-3-9(26-2)6-11(10)22(24)25/h3-6H,7H2,1-2H3,(H,20,23)