methyl 2-(tert-butylamino)-3-[3-(trifluoromethyl)phenyl]-2H-1,3-thiazole-4-carboxylate

Systemtic Name: methyl 2-(tert-butylamino)-3-[3-(trifluoromethyl)phenyl]-2H-1,3-thiazole-4-carboxylate Openeye Name: methyl 2-(tert-butylamino)-3-[3-(trifluoromethyl)phenyl]-2H-thiazole-4-carboxylate CAS Name: 2-(tert-butylamino)-3-[3-(trifluoromethyl)phenyl]-2H-thiazole-4-carboxylic acid methyl ester IUPAC Name: methyl 2-(tert-butylamino)-3-[3-(trifluoromethyl)phenyl]-2H-1,3-thiazole-4-carboxylate Traditional Name: 2-(tert-butylamino)-3-[3-(trifluoromethyl)phenyl]-4-thiazoline-4-carboxylic acid methyl ester Formula: C16H19F3N2O2S MolecularWeight: 360.39447

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC1N(C(=CS1)C(=O)OC)C2=CC=CC(=C2)C(F)(F)F

Isomeric SMILES

CC(C)(C)NC1N(C(=CS1)C(=O)OC)C2=CC=CC(=C2)C(F)(F)F

InChI

InChI=1S/C16H19F3N2O2S/c1-15(2,3)20-14-21(12(9-24-14)13(22)23-4)11-7-5-6-10(8-11)16(17,18)19/h5-9,14,20H,1-4H3