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

Systemtic Name: N-(1-adamantyl)-3-[4-bromanyl-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]propanamide Openeye Name: N-(1-adamantyl)-3-[4-bromo-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]propanamide CAS Name: N-(1-adamantyl)-3-[4-bromo-5-methyl-3-(trifluoromethyl)-1-pyrazolyl]propanamide IUPAC Name: N-(1-adamantyl)-3-[4-bromo-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]propanamide Traditional Name: N-(1-adamantyl)-3-[4-bromo-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]propionamide Formula: C18H23BrF3N3O MolecularWeight: 434.29393

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCC(=O)NC23CC4CC(C2)CC(C4)C3)C(F)(F)F)Br

Isomeric SMILES

CC1=C(C(=NN1CCC(=O)NC23CC4CC(C2)CC(C4)C3)C(F)(F)F)Br

InChI

InChI=1S/C18H23BrF3N3O/c1-10-15(19)16(18(20,21)22)24-25(10)3-2-14(26)23-17-7-11-4-12(8-17)6-13(5-11)9-17/h11-13H,2-9H2,1H3,(H,23,26)