(2S)-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-(4-methylphenyl)propanamide

Systemtic Name: (2S)-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-(4-methylphenyl)propanamide Openeye Name: (2S)-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-(p-tolyl)propanamide CAS Name: (2S)-2-[(4,6-dimethyl-2-pyrimidinyl)thio]-N-(4-methylphenyl)propanamide IUPAC Name: (2S)-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-(4-methylphenyl)propanamide Traditional Name: (2S)-2-[(4,6-dimethylpyrimidin-2-yl)thio]-N-(p-tolyl)propionamide Formula: C16H19N3OS MolecularWeight: 301.40656

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H19N3OS/c1-10-5-7-14(8-6-10)19-15(20)13(4)21-16-17-11(2)9-12(3)18-16/h5-9,13H,1-4H3,(H,19,20)/t13-/m0/s1