2-[3-tert-butyl-5-(trifluoromethyl)pyrazol-1-yl]-1,3-thiazole-4-carboxylate

Systemtic Name: 2-[3-tert-butyl-5-(trifluoromethyl)pyrazol-1-yl]-1,3-thiazole-4-carboxylate Openeye Name: 2-[3-tert-butyl-5-(trifluoromethyl)pyrazol-1-yl]thiazole-4-carboxylate CAS Name: 2-[3-tert-butyl-5-(trifluoromethyl)-1-pyrazolyl]-4-thiazolecarboxylate IUPAC Name: 2-[3-tert-butyl-5-(trifluoromethyl)pyrazol-1-yl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[3-tert-butyl-5-(trifluoromethyl)pyrazol-1-yl]thiazole-4-carboxylate Formula: C12H11F3N3O2S- MolecularWeight: 318.29485

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1)C(F)(F)F)C2=NC(=CS2)C(=O)[O-]

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1)C(F)(F)F)C2=NC(=CS2)C(=O)[O-]

InChI

InChI=1S/C12H12F3N3O2S/c1-11(2,3)7-4-8(12(13,14)15)18(17-7)10-16-6(5-21-10)9(19)20/h4-5H,1-3H3,(H,19,20)/p-1