2-[4-methyl-3-phenyl-5-[3-(trifluoromethyl)phenyl]pyrazol-1-yl]-1,3-thiazole-4-carboxylic acid

Systemtic Name: 2-[4-methyl-3-phenyl-5-[3-(trifluoromethyl)phenyl]pyrazol-1-yl]-1,3-thiazole-4-carboxylic acid Openeye Name: 2-[4-methyl-3-phenyl-5-[3-(trifluoromethyl)phenyl]pyrazol-1-yl]thiazole-4-carboxylic acid CAS Name: 2-[4-methyl-3-phenyl-5-[3-(trifluoromethyl)phenyl]-1-pyrazolyl]-4-thiazolecarboxylic acid IUPAC Name: 2-[4-methyl-3-phenyl-5-[3-(trifluoromethyl)phenyl]pyrazol-1-yl]-1,3-thiazole-4-carboxylic acid Traditional Name: 2-[4-methyl-3-phenyl-5-[3-(trifluoromethyl)phenyl]pyrazol-1-yl]thiazole-4-carboxylic acid Formula: C21H14F3N3O2S MolecularWeight: 429.41497

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(N=C1C2=CC=CC=C2)C3=NC(=CS3)C(=O)O)C4=CC(=CC=C4)C(F)(F)F

Isomeric SMILES

CC1=C(N(N=C1C2=CC=CC=C2)C3=NC(=CS3)C(=O)O)C4=CC(=CC=C4)C(F)(F)F

InChI

InChI=1S/C21H14F3N3O2S/c1-12-17(13-6-3-2-4-7-13)26-27(20-25-16(11-30-20)19(28)29)18(12)14-8-5-9-15(10-14)21(22,23)24/h2-11H,1H3,(H,28,29)