N-(1-adamantyl)-2-[4-bromanyl-5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]propanamide

Systemtic Name: N-(1-adamantyl)-2-[4-bromanyl-5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]propanamide Openeye Name: N-(1-adamantyl)-2-[4-bromo-5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]propanamide CAS Name: N-(1-adamantyl)-2-[4-bromo-5-cyclopropyl-3-(trifluoromethyl)-1-pyrazolyl]propanamide IUPAC Name: N-(1-adamantyl)-2-[4-bromo-5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]propanamide Traditional Name: N-(1-adamantyl)-2-[4-bromo-5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]propionamide Formula: C20H25BrF3N3O MolecularWeight: 460.33121

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC12CC3CC(C1)CC(C3)C2)N4C(=C(C(=N4)C(F)(F)F)Br)C5CC5

Isomeric SMILES

CC(C(=O)NC12CC3CC(C1)CC(C3)C2)N4C(=C(C(=N4)C(F)(F)F)Br)C5CC5

InChI

InChI=1S/C20H25BrF3N3O/c1-10(27-16(14-2-3-14)15(21)17(26-27)20(22,23)24)18(28)25-19-7-11-4-12(8-19)6-13(5-11)9-19/h10-14H,2-9H2,1H3,(H,25,28)