3-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-N-(2-phenylsulfanylphenyl)propanamide

Systemtic Name: 3-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-N-(2-phenylsulfanylphenyl)propanamide Openeye Name: 3-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-N-(2-phenylsulfanylphenyl)propanamide CAS Name: 3-[5-methyl-3-(trifluoromethyl)-1-pyrazolyl]-N-[2-(phenylthio)phenyl]propanamide IUPAC Name: 3-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-N-(2-phenylsulfanylphenyl)propanamide Traditional Name: 3-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-N-[2-(phenylthio)phenyl]propionamide Formula: C20H18F3N3OS MolecularWeight: 405.43663

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CCC(=O)NC2=CC=CC=C2SC3=CC=CC=C3)C(F)(F)F

Isomeric SMILES

CC1=CC(=NN1CCC(=O)NC2=CC=CC=C2SC3=CC=CC=C3)C(F)(F)F

InChI

InChI=1S/C20H18F3N3OS/c1-14-13-18(20(21,22)23)25-26(14)12-11-19(27)24-16-9-5-6-10-17(16)28-15-7-3-2-4-8-15/h2-10,13H,11-12H2,1H3,(H,24,27)