6-phenyl-2-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]-4-(trifluoromethyl)pyridazin-3-one

Systemtic Name: 6-phenyl-2-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]-4-(trifluoromethyl)pyridazin-3-one Openeye Name: 6-phenyl-2-[[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methyl]-4-(trifluoromethyl)pyridazin-3-one CAS Name: 6-phenyl-2-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]-4-(trifluoromethyl)-3-pyridazinone IUPAC Name: 6-phenyl-2-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]-4-(trifluoromethyl)pyridazin-3-one Traditional Name: 6-phenyl-2-[[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methyl]-4-(trifluoromethyl)pyridazin-3-one Formula: C18H11F3N4O2S MolecularWeight: 404.36575

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C(=O)C(=C2)C(F)(F)F)CC3=NC(=NO3)C4=CC=CS4

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C(=O)C(=C2)C(F)(F)F)CC3=NC(=NO3)C4=CC=CS4

InChI

InChI=1S/C18H11F3N4O2S/c19-18(20,21)12-9-13(11-5-2-1-3-6-11)23-25(17(12)26)10-15-22-16(24-27-15)14-7-4-8-28-14/h1-9H,10H2