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

Systemtic Name: N-(1-adamantyl)-N-ethyl-6-methyl-4-oxidanylidene-1-[2-(trifluoromethyl)phenyl]pyridazine-3-carboxamide Openeye Name: N-(1-adamantyl)-N-ethyl-6-methyl-4-oxo-1-[2-(trifluoromethyl)phenyl]pyridazine-3-carboxamide CAS Name: N-(1-adamantyl)-N-ethyl-6-methyl-4-oxo-1-[2-(trifluoromethyl)phenyl]-3-pyridazinecarboxamide IUPAC Name: N-(1-adamantyl)-N-ethyl-6-methyl-4-oxo-1-[2-(trifluoromethyl)phenyl]pyridazine-3-carboxamide Traditional Name: N-(1-adamantyl)-N-ethyl-4-keto-6-methyl-1-[2-(trifluoromethyl)phenyl]pyridazine-3-carboxamide Formula: C25H28F3N3O2 MolecularWeight: 459.50393

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C(=O)C1=NN(C(=CC1=O)C)C2=CC=CC=C2C(F)(F)F)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CCN(C(=O)C1=NN(C(=CC1=O)C)C2=CC=CC=C2C(F)(F)F)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C25H28F3N3O2/c1-3-30(24-12-16-9-17(13-24)11-18(10-16)14-24)23(33)22-21(32)8-15(2)31(29-22)20-7-5-4-6-19(20)25(26,27)28/h4-8,16-18H,3,9-14H2,1-2H3