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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=C1)C2=CC=CC=C2)SC(C)C(=O)NC3=CC=CC=C3C(F)(F)F

Isomeric SMILES

CC1=NC(=NC(=C1)C2=CC=CC=C2)S[C@@H](C)C(=O)NC3=CC=CC=C3C(F)(F)F

InChI

InChI=1S/C21H18F3N3OS/c1-13-12-18(15-8-4-3-5-9-15)27-20(25-13)29-14(2)19(28)26-17-11-7-6-10-16(17)21(22,23)24/h3-12,14H,1-2H3,(H,26,28)/t14-/m0/s1