N-[(5-ethylthiophen-2-yl)methyl]-6-methyl-4-oxidanylidene-1-[2-(trifluoromethyl)phenyl]pyridazine-3-carboxamide

Systemtic Name: N-[(5-ethylthiophen-2-yl)methyl]-6-methyl-4-oxidanylidene-1-[2-(trifluoromethyl)phenyl]pyridazine-3-carboxamide Openeye Name: N-[(5-ethyl-2-thienyl)methyl]-6-methyl-4-oxo-1-[2-(trifluoromethyl)phenyl]pyridazine-3-carboxamide CAS Name: N-[(5-ethyl-2-thiophenyl)methyl]-6-methyl-4-oxo-1-[2-(trifluoromethyl)phenyl]-3-pyridazinecarboxamide IUPAC Name: N-[(5-ethylthiophen-2-yl)methyl]-6-methyl-4-oxo-1-[2-(trifluoromethyl)phenyl]pyridazine-3-carboxamide Traditional Name: N-[(5-ethyl-2-thienyl)methyl]-4-keto-6-methyl-1-[2-(trifluoromethyl)phenyl]pyridazine-3-carboxamide Formula: C20H18F3N3O2S MolecularWeight: 421.43603

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(S1)CNC(=O)C2=NN(C(=CC2=O)C)C3=CC=CC=C3C(F)(F)F

Isomeric SMILES

CCC1=CC=C(S1)CNC(=O)C2=NN(C(=CC2=O)C)C3=CC=CC=C3C(F)(F)F

InChI

InChI=1S/C20H18F3N3O2S/c1-3-13-8-9-14(29-13)11-24-19(28)18-17(27)10-12(2)26(25-18)16-7-5-4-6-15(16)20(21,22)23/h4-10H,3,11H2,1-2H3,(H,24,28)