N-(2-adamantyl)-1,4-dimethyl-5-[2-(trifluoromethyl)phenyl]pyrazole-3-carboxamide

Systemtic Name: N-(2-adamantyl)-1,4-dimethyl-5-[2-(trifluoromethyl)phenyl]pyrazole-3-carboxamide Openeye Name: N-(2-adamantyl)-1,4-dimethyl-5-[2-(trifluoromethyl)phenyl]pyrazole-3-carboxamide CAS Name: N-(2-adamantyl)-1,4-dimethyl-5-[2-(trifluoromethyl)phenyl]-3-pyrazolecarboxamide IUPAC Name: N-(2-adamantyl)-1,4-dimethyl-5-[2-(trifluoromethyl)phenyl]pyrazole-3-carboxamide Traditional Name: N-(2-adamantyl)-1,4-dimethyl-5-[2-(trifluoromethyl)phenyl]pyrazole-3-carboxamide Formula: C23H26F3N3O MolecularWeight: 417.46725

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(N=C1C(=O)NC2C3CC4CC(C3)CC2C4)C)C5=CC=CC=C5C(F)(F)F

Isomeric SMILES

CC1=C(N(N=C1C(=O)NC2C3CC4CC(C3)CC2C4)C)C5=CC=CC=C5C(F)(F)F

InChI

InChI=1S/C23H26F3N3O/c1-12-19(22(30)27-20-15-8-13-7-14(10-15)11-16(20)9-13)28-29(2)21(12)17-5-3-4-6-18(17)23(24,25)26/h3-6,13-16,20H,7-11H2,1-2H3,(H,27,30)