3-(2-methyl-6-phenyl-pyrimidin-4-yl)sulfanyl-N-[3-(trifluoromethyl)phenyl]propanamide

Systemtic Name: 3-(2-methyl-6-phenyl-pyrimidin-4-yl)sulfanyl-N-[3-(trifluoromethyl)phenyl]propanamide Openeye Name: 3-(2-methyl-6-phenyl-pyrimidin-4-yl)sulfanyl-N-[3-(trifluoromethyl)phenyl]propanamide CAS Name: 3-[(2-methyl-6-phenyl-4-pyrimidinyl)thio]-N-[3-(trifluoromethyl)phenyl]propanamide IUPAC Name: 3-(2-methyl-6-phenylpyrimidin-4-yl)sulfanyl-N-[3-(trifluoromethyl)phenyl]propanamide Traditional Name: 3-[(2-methyl-6-phenyl-pyrimidin-4-yl)thio]-N-[3-(trifluoromethyl)phenyl]propionamide Formula: C21H18F3N3OS MolecularWeight: 417.44733

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=N1)SCCC(=O)NC2=CC=CC(=C2)C(F)(F)F)C3=CC=CC=C3

Isomeric SMILES

CC1=NC(=CC(=N1)SCCC(=O)NC2=CC=CC(=C2)C(F)(F)F)C3=CC=CC=C3

InChI

InChI=1S/C21H18F3N3OS/c1-14-25-18(15-6-3-2-4-7-15)13-20(26-14)29-11-10-19(28)27-17-9-5-8-16(12-17)21(22,23)24/h2-9,12-13H,10-11H2,1H3,(H,27,28)