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

Systemtic Name: 2-[6-(4-bromophenyl)pyridazin-3-yl]sulfanyl-N-[2-methoxy-5-(trifluoromethyl)phenyl]ethanamide Openeye Name: 2-[6-(4-bromophenyl)pyridazin-3-yl]sulfanyl-N-[2-methoxy-5-(trifluoromethyl)phenyl]acetamide CAS Name: 2-[[6-(4-bromophenyl)-3-pyridazinyl]thio]-N-[2-methoxy-5-(trifluoromethyl)phenyl]acetamide IUPAC Name: 2-[6-(4-bromophenyl)pyridazin-3-yl]sulfanyl-N-[2-methoxy-5-(trifluoromethyl)phenyl]acetamide Traditional Name: 2-[[6-(4-bromophenyl)pyridazin-3-yl]thio]-N-[2-methoxy-5-(trifluoromethyl)phenyl]acetamide Formula: C20H15BrF3N3O2S MolecularWeight: 498.31621

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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)Br

Isomeric SMILES

COC1=C(C=C(C=C1)C(F)(F)F)NC(=O)CSC2=NN=C(C=C2)C3=CC=C(C=C3)Br

InChI

InChI=1S/C20H15BrF3N3O2S/c1-29-17-8-4-13(20(22,23)24)10-16(17)25-18(28)11-30-19-9-7-15(26-27-19)12-2-5-14(21)6-3-12/h2-10H,11H2,1H3,(H,25,28)