N-[2-(dimethylamino)-2-thiophen-2-yl-ethyl]-1-(6-methoxypyridazin-3-yl)-5-(trifluoromethyl)pyrazole-4-carboxamide

Systemtic Name: N-[2-(dimethylamino)-2-thiophen-2-yl-ethyl]-1-(6-methoxypyridazin-3-yl)-5-(trifluoromethyl)pyrazole-4-carboxamide Openeye Name: N-[2-(dimethylamino)-2-(2-thienyl)ethyl]-1-(6-methoxypyridazin-3-yl)-5-(trifluoromethyl)pyrazole-4-carboxamide CAS Name: N-[2-(dimethylamino)-2-thiophen-2-ylethyl]-1-(6-methoxy-3-pyridazinyl)-5-(trifluoromethyl)-4-pyrazolecarboxamide IUPAC Name: N-[2-(dimethylamino)-2-thiophen-2-ylethyl]-1-(6-methoxypyridazin-3-yl)-5-(trifluoromethyl)pyrazole-4-carboxamide Traditional Name: N-[2-(dimethylamino)-2-(2-thienyl)ethyl]-1-(6-methoxypyridazin-3-yl)-5-(trifluoromethyl)pyrazole-4-carboxamide Formula: C18H19F3N6O2S MolecularWeight: 440.44267

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(CNC(=O)C1=C(N(N=C1)C2=NN=C(C=C2)OC)C(F)(F)F)C3=CC=CS3

Isomeric SMILES

CN(C)C(CNC(=O)C1=C(N(N=C1)C2=NN=C(C=C2)OC)C(F)(F)F)C3=CC=CS3

InChI

InChI=1S/C18H19F3N6O2S/c1-26(2)12(13-5-4-8-30-13)10-22-17(28)11-9-23-27(16(11)18(19,20)21)14-6-7-15(29-3)25-24-14/h4-9,12H,10H2,1-3H3,(H,22,28)