N-(2-ethylsulfanylethyl)-4-[3-[3-(trifluoromethyl)phenyl]-1H-pyrazol-5-yl]benzamide

Systemtic Name: N-(2-ethylsulfanylethyl)-4-[3-[3-(trifluoromethyl)phenyl]-1H-pyrazol-5-yl]benzamide Openeye Name: N-(2-ethylsulfanylethyl)-4-[3-[3-(trifluoromethyl)phenyl]-1H-pyrazol-5-yl]benzamide CAS Name: N-[2-(ethylthio)ethyl]-4-[3-[3-(trifluoromethyl)phenyl]-1H-pyrazol-5-yl]benzamide IUPAC Name: N-(2-ethylsulfanylethyl)-4-[3-[3-(trifluoromethyl)phenyl]-1H-pyrazol-5-yl]benzamide Traditional Name: N-[2-(ethylthio)ethyl]-4-[3-[3-(trifluoromethyl)phenyl]-1H-pyrazol-5-yl]benzamide Formula: C21H20F3N3OS MolecularWeight: 419.46321

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCSCCNC(=O)C1=CC=C(C=C1)C2=CC(=NN2)C3=CC(=CC=C3)C(F)(F)F

Isomeric SMILES

CCSCCNC(=O)C1=CC=C(C=C1)C2=CC(=NN2)C3=CC(=CC=C3)C(F)(F)F

InChI

InChI=1S/C21H20F3N3OS/c1-2-29-11-10-25-20(28)15-8-6-14(7-9-15)18-13-19(27-26-18)16-4-3-5-17(12-16)21(22,23)24/h3-9,12-13H,2,10-11H2,1H3,(H,25,28)(H,26,27)