(2S)-2-(5-cyano-2,6-dimethyl-pyrimidin-4-yl)sulfanyl-N-(3-fluorophenyl)propanamide

Systemtic Name: (2S)-2-(5-cyano-2,6-dimethyl-pyrimidin-4-yl)sulfanyl-N-(3-fluorophenyl)propanamide Openeye Name: (2S)-2-(5-cyano-2,6-dimethyl-pyrimidin-4-yl)sulfanyl-N-(3-fluorophenyl)propanamide CAS Name: (2S)-2-[(5-cyano-2,6-dimethyl-4-pyrimidinyl)thio]-N-(3-fluorophenyl)propanamide IUPAC Name: (2S)-2-(5-cyano-2,6-dimethylpyrimidin-4-yl)sulfanyl-N-(3-fluorophenyl)propanamide Traditional Name: (2S)-2-[(5-cyano-2,6-dimethyl-pyrimidin-4-yl)thio]-N-(3-fluorophenyl)propionamide Formula: C16H15FN4OS MolecularWeight: 330.379903

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C)SC(C)C(=O)NC2=CC(=CC=C2)F)C#N

Isomeric SMILES

CC1=C(C(=NC(=N1)C)S[C@@H](C)C(=O)NC2=CC(=CC=C2)F)C#N

InChI

InChI=1S/C16H15FN4OS/c1-9-14(8-18)16(20-11(3)19-9)23-10(2)15(22)21-13-6-4-5-12(17)7-13/h4-7,10H,1-3H3,(H,21,22)/t10-/m0/s1