1-(6-methoxypyridazin-3-yl)-N-[(1-phenylpyrrolidin-3-yl)methyl]-5-(trifluoromethyl)pyrazole-4-carboxamide

Systemtic Name: 1-(6-methoxypyridazin-3-yl)-N-[(1-phenylpyrrolidin-3-yl)methyl]-5-(trifluoromethyl)pyrazole-4-carboxamide Openeye Name: 1-(6-methoxypyridazin-3-yl)-N-[(1-phenylpyrrolidin-3-yl)methyl]-5-(trifluoromethyl)pyrazole-4-carboxamide CAS Name: 1-(6-methoxy-3-pyridazinyl)-N-[(1-phenyl-3-pyrrolidinyl)methyl]-5-(trifluoromethyl)-4-pyrazolecarboxamide IUPAC Name: 1-(6-methoxypyridazin-3-yl)-N-[(1-phenylpyrrolidin-3-yl)methyl]-5-(trifluoromethyl)pyrazole-4-carboxamide Traditional Name: 1-(6-methoxypyridazin-3-yl)-N-[(1-phenylpyrrolidin-3-yl)methyl]-5-(trifluoromethyl)pyrazole-4-carboxamide Formula: C21H21F3N6O2 MolecularWeight: 446.42565

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NN=C(C=C1)N2C(=C(C=N2)C(=O)NCC3CCN(C3)C4=CC=CC=C4)C(F)(F)F

Isomeric SMILES

COC1=NN=C(C=C1)N2C(=C(C=N2)C(=O)NCC3CCN(C3)C4=CC=CC=C4)C(F)(F)F

InChI

InChI=1S/C21H21F3N6O2/c1-32-18-8-7-17(27-28-18)30-19(21(22,23)24)16(12-26-30)20(31)25-11-14-9-10-29(13-14)15-5-3-2-4-6-15/h2-8,12,14H,9-11,13H2,1H3,(H,25,31)