N-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-3-(2-fluorophenyl)sulfanyl-propanamide

Systemtic Name: N-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-3-(2-fluorophenyl)sulfanyl-propanamide Openeye Name: N-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-3-(2-fluorophenyl)sulfanyl-propanamide CAS Name: N-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-3-[(2-fluorophenyl)thio]propanamide IUPAC Name: N-(3,5-dimethyl-1-phenylpyrazol-4-yl)-3-(2-fluorophenyl)sulfanylpropanamide Traditional Name: N-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-3-[(2-fluorophenyl)thio]propionamide Formula: C20H20FN3OS MolecularWeight: 369.455703

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)NC(=O)CCSC3=CC=CC=C3F

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)NC(=O)CCSC3=CC=CC=C3F

InChI

InChI=1S/C20H20FN3OS/c1-14-20(15(2)24(23-14)16-8-4-3-5-9-16)22-19(25)12-13-26-18-11-7-6-10-17(18)21/h3-11H,12-13H2,1-2H3,(H,22,25)