N-[2-(4-methylpiperidin-1-yl)-2-thiophen-2-yl-ethyl]-1-(6-oxidanylidene-1H-pyridazin-3-yl)-5-(trifluoromethyl)pyrazole-4-carboxamide

Systemtic Name: N-[2-(4-methylpiperidin-1-yl)-2-thiophen-2-yl-ethyl]-1-(6-oxidanylidene-1H-pyridazin-3-yl)-5-(trifluoromethyl)pyrazole-4-carboxamide Openeye Name: N-[2-(4-methyl-1-piperidyl)-2-(2-thienyl)ethyl]-1-(6-oxo-1H-pyridazin-3-yl)-5-(trifluoromethyl)pyrazole-4-carboxamide CAS Name: N-[2-(4-methyl-1-piperidinyl)-2-thiophen-2-ylethyl]-1-(6-oxo-1H-pyridazin-3-yl)-5-(trifluoromethyl)-4-pyrazolecarboxamide IUPAC Name: N-[2-(4-methylpiperidin-1-yl)-2-thiophen-2-ylethyl]-1-(6-oxo-1H-pyridazin-3-yl)-5-(trifluoromethyl)pyrazole-4-carboxamide Traditional Name: 1-(6-keto-1H-pyridazin-3-yl)-N-[2-(4-methylpiperidino)-2-(2-thienyl)ethyl]-5-(trifluoromethyl)pyrazole-4-carboxamide Formula: C21H23F3N6O2S MolecularWeight: 480.50653

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(CNC(=O)C2=C(N(N=C2)C3=NNC(=O)C=C3)C(F)(F)F)C4=CC=CS4

Isomeric SMILES

CC1CCN(CC1)C(CNC(=O)C2=C(N(N=C2)C3=NNC(=O)C=C3)C(F)(F)F)C4=CC=CS4

InChI

InChI=1S/C21H23F3N6O2S/c1-13-6-8-29(9-7-13)15(16-3-2-10-33-16)12-25-20(32)14-11-26-30(19(14)21(22,23)24)17-4-5-18(31)28-27-17/h2-5,10-11,13,15H,6-9,12H2,1H3,(H,25,32)(H,28,31)