ethyl 4-[[1-(6-methoxypyridazin-3-yl)-5-(trifluoromethyl)pyrazol-4-yl]carbonylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[[1-(6-methoxypyridazin-3-yl)-5-(trifluoromethyl)pyrazol-4-yl]carbonylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[1-(6-methoxypyridazin-3-yl)-5-(trifluoromethyl)pyrazole-4-carbonyl]amino]piperidine-1-carboxylate CAS Name: 4-[[[1-(6-methoxy-3-pyridazinyl)-5-(trifluoromethyl)-4-pyrazolyl]-oxomethyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[1-(6-methoxypyridazin-3-yl)-5-(trifluoromethyl)pyrazole-4-carbonyl]amino]piperidine-1-carboxylate Traditional Name: 4-[[1-(6-methoxypyridazin-3-yl)-5-(trifluoromethyl)pyrazole-4-carbonyl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C18H21F3N6O4 MolecularWeight: 442.39235

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)C2=C(N(N=C2)C3=NN=C(C=C3)OC)C(F)(F)F

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)C2=C(N(N=C2)C3=NN=C(C=C3)OC)C(F)(F)F

InChI

InChI=1S/C18H21F3N6O4/c1-3-31-17(29)26-8-6-11(7-9-26)23-16(28)12-10-22-27(15(12)18(19,20)21)13-4-5-14(30-2)25-24-13/h4-5,10-11H,3,6-9H2,1-2H3,(H,23,28)