(2S)-N-(2,6-dimethylphenyl)-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-propanamide

Systemtic Name: (2S)-N-(2,6-dimethylphenyl)-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-propanamide Openeye Name: (2S)-N-(2,6-dimethylphenyl)-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-propanamide CAS Name: (2S)-N-(2,6-dimethylphenyl)-2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]propanamide IUPAC Name: (2S)-N-(2,6-dimethylphenyl)-2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanylpropanamide Traditional Name: (2S)-N-(2,6-dimethylphenyl)-2-[(4-methyl-6-phenyl-pyrimidin-2-yl)thio]propionamide Formula: C22H23N3OS MolecularWeight: 377.50252

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)C(C)SC2=NC(=CC(=N2)C)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)[C@H](C)SC2=NC(=CC(=N2)C)C3=CC=CC=C3

InChI

InChI=1S/C22H23N3OS/c1-14-9-8-10-15(2)20(14)25-21(26)17(4)27-22-23-16(3)13-19(24-22)18-11-6-5-7-12-18/h5-13,17H,1-4H3,(H,25,26)/t17-/m0/s1