(2S)-N-(3-fluoranyl-4-methyl-phenyl)-2-(4,5,6-trimethylpyrimidin-2-yl)sulfanyl-propanamide

Systemtic Name: (2S)-N-(3-fluoranyl-4-methyl-phenyl)-2-(4,5,6-trimethylpyrimidin-2-yl)sulfanyl-propanamide Openeye Name: (2S)-N-(3-fluoro-4-methyl-phenyl)-2-(4,5,6-trimethylpyrimidin-2-yl)sulfanyl-propanamide CAS Name: (2S)-N-(3-fluoro-4-methylphenyl)-2-[(4,5,6-trimethyl-2-pyrimidinyl)thio]propanamide IUPAC Name: (2S)-N-(3-fluoro-4-methylphenyl)-2-(4,5,6-trimethylpyrimidin-2-yl)sulfanylpropanamide Traditional Name: (2S)-N-(3-fluoro-4-methyl-phenyl)-2-[(4,5,6-trimethylpyrimidin-2-yl)thio]propionamide Formula: C17H20FN3OS MolecularWeight: 333.423603

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C(C)SC2=NC(=C(C(=N2)C)C)C)F

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)[C@H](C)SC2=NC(=C(C(=N2)C)C)C)F

InChI

InChI=1S/C17H20FN3OS/c1-9-6-7-14(8-15(9)18)21-16(22)13(5)23-17-19-11(3)10(2)12(4)20-17/h6-8,13H,1-5H3,(H,21,22)/t13-/m0/s1