N-[2-methoxy-5-(trifluoromethyl)phenyl]-2-[6-(4-nitrophenyl)pyridazin-3-yl]sulfanyl-ethanamide

Systemtic Name: N-[2-methoxy-5-(trifluoromethyl)phenyl]-2-[6-(4-nitrophenyl)pyridazin-3-yl]sulfanyl-ethanamide Openeye Name: N-[2-methoxy-5-(trifluoromethyl)phenyl]-2-[6-(4-nitrophenyl)pyridazin-3-yl]sulfanyl-acetamide CAS Name: N-[2-methoxy-5-(trifluoromethyl)phenyl]-2-[[6-(4-nitrophenyl)-3-pyridazinyl]thio]acetamide IUPAC Name: N-[2-methoxy-5-(trifluoromethyl)phenyl]-2-[6-(4-nitrophenyl)pyridazin-3-yl]sulfanylacetamide Traditional Name: N-[2-methoxy-5-(trifluoromethyl)phenyl]-2-[[6-(4-nitrophenyl)pyridazin-3-yl]thio]acetamide Formula: C20H15F3N4O4S MolecularWeight: 464.41771

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(F)(F)F)NC(=O)CSC2=NN=C(C=C2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C(F)(F)F)NC(=O)CSC2=NN=C(C=C2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H15F3N4O4S/c1-31-17-8-4-13(20(21,22)23)10-16(17)24-18(28)11-32-19-9-7-15(25-26-19)12-2-5-14(6-3-12)27(29)30/h2-10H,11H2,1H3,(H,24,28)