4-methyl-3-(3-methylbutyl)-2-[4-[[3-(trifluoromethyl)phenyl]carbonylamino]phenyl]carbonylimino-1,3-thiazole-5-carboxylic acid

Systemtic Name: 4-methyl-3-(3-methylbutyl)-2-[4-[[3-(trifluoromethyl)phenyl]carbonylamino]phenyl]carbonylimino-1,3-thiazole-5-carboxylic acid Openeye Name: 3-isopentyl-4-methyl-2-[4-[[3-(trifluoromethyl)benzoyl]amino]benzoyl]imino-thiazole-5-carboxylic acid CAS Name: 4-methyl-3-(3-methylbutyl)-2-[oxo-[4-[[oxo-[3-(trifluoromethyl)phenyl]methyl]amino]phenyl]methyl]imino-5-thiazolecarboxylic acid IUPAC Name: 4-methyl-3-(3-methylbutyl)-2-[4-[[3-(trifluoromethyl)benzoyl]amino]benzoyl]imino-1,3-thiazole-5-carboxylic acid Traditional Name: 3-isoamyl-4-methyl-2-[4-[[3-(trifluoromethyl)benzoyl]amino]benzoyl]imino-4-thiazoline-5-carboxylic acid Formula: C25H24F3N3O4S MolecularWeight: 519.53597

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=NC(=O)C2=CC=C(C=C2)NC(=O)C3=CC(=CC=C3)C(F)(F)F)N1CCC(C)C)C(=O)O

Isomeric SMILES

CC1=C(SC(=NC(=O)C2=CC=C(C=C2)NC(=O)C3=CC(=CC=C3)C(F)(F)F)N1CCC(C)C)C(=O)O

InChI

InChI=1S/C25H24F3N3O4S/c1-14(2)11-12-31-15(3)20(23(34)35)36-24(31)30-21(32)16-7-9-19(10-8-16)29-22(33)17-5-4-6-18(13-17)25(26,27)28/h4-10,13-14H,11-12H2,1-3H3,(H,29,33)(H,34,35)