N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-1-methyl-5-(trifluoromethyl)pyrazole-3-carboxamide

Systemtic Name: N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-1-methyl-5-(trifluoromethyl)pyrazole-3-carboxamide Openeye Name: N-[4-(1-adamantyl)thiazol-2-yl]-1-methyl-5-(trifluoromethyl)pyrazole-3-carboxamide CAS Name: N-[4-(1-adamantyl)-2-thiazolyl]-1-methyl-5-(trifluoromethyl)-3-pyrazolecarboxamide IUPAC Name: N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-1-methyl-5-(trifluoromethyl)pyrazole-3-carboxamide Traditional Name: N-[4-(1-adamantyl)thiazol-2-yl]-1-methyl-5-(trifluoromethyl)pyrazole-3-carboxamide Formula: C19H21F3N4OS MolecularWeight: 410.45645

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC(=N1)C(=O)NC2=NC(=CS2)C34CC5CC(C3)CC(C5)C4)C(F)(F)F

Isomeric SMILES

CN1C(=CC(=N1)C(=O)NC2=NC(=CS2)C34CC5CC(C3)CC(C5)C4)C(F)(F)F

InChI

InChI=1S/C19H21F3N4OS/c1-26-15(19(20,21)22)5-13(25-26)16(27)24-17-23-14(9-28-17)18-6-10-2-11(7-18)4-12(3-10)8-18/h5,9-12H,2-4,6-8H2,1H3,(H,23,24,27)