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

Systemtic Name: N-(1-adamantyl)-2-[4-bromanyl-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]ethanamide Openeye Name: N-(1-adamantyl)-2-[4-bromo-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]acetamide CAS Name: N-(1-adamantyl)-2-[4-bromo-5-methyl-3-(trifluoromethyl)-1-pyrazolyl]acetamide IUPAC Name: N-(1-adamantyl)-2-[4-bromo-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]acetamide Traditional Name: N-(1-adamantyl)-2-[4-bromo-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]acetamide Formula: C17H21BrF3N3O MolecularWeight: 420.26735

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)NC23CC4CC(C2)CC(C4)C3)C(F)(F)F)Br

Isomeric SMILES

CC1=C(C(=NN1CC(=O)NC23CC4CC(C2)CC(C4)C3)C(F)(F)F)Br

InChI

InChI=1S/C17H21BrF3N3O/c1-9-14(18)15(17(19,20)21)23-24(9)8-13(25)22-16-5-10-2-11(6-16)4-12(3-10)7-16/h10-12H,2-8H2,1H3,(H,22,25)