N-[1-(2-azanyl-2-oxidanylidene-ethyl)piperidin-4-yl]-6-methyl-4-oxidanylidene-1-[2-(trifluoromethyl)phenyl]pyridazine-3-carboxamide

Systemtic Name: N-[1-(2-azanyl-2-oxidanylidene-ethyl)piperidin-4-yl]-6-methyl-4-oxidanylidene-1-[2-(trifluoromethyl)phenyl]pyridazine-3-carboxamide Openeye Name: N-[1-(2-amino-2-oxo-ethyl)-4-piperidyl]-6-methyl-4-oxo-1-[2-(trifluoromethyl)phenyl]pyridazine-3-carboxamide CAS Name: N-[1-(2-amino-2-oxoethyl)-4-piperidinyl]-6-methyl-4-oxo-1-[2-(trifluoromethyl)phenyl]-3-pyridazinecarboxamide IUPAC Name: N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-6-methyl-4-oxo-1-[2-(trifluoromethyl)phenyl]pyridazine-3-carboxamide Traditional Name: N-[1-(2-amino-2-keto-ethyl)-4-piperidyl]-4-keto-6-methyl-1-[2-(trifluoromethyl)phenyl]pyridazine-3-carboxamide Formula: C20H22F3N5O3 MolecularWeight: 437.41559

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=NN1C2=CC=CC=C2C(F)(F)F)C(=O)NC3CCN(CC3)CC(=O)N

Isomeric SMILES

CC1=CC(=O)C(=NN1C2=CC=CC=C2C(F)(F)F)C(=O)NC3CCN(CC3)CC(=O)N

InChI

InChI=1S/C20H22F3N5O3/c1-12-10-16(29)18(19(31)25-13-6-8-27(9-7-13)11-17(24)30)26-28(12)15-5-3-2-4-14(15)20(21,22)23/h2-5,10,13H,6-9,11H2,1H3,(H2,24,30)(H,25,31)