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

Systemtic Name: (2S)-N-(2-methylphenyl)-2-(2-methyl-6-phenyl-pyrimidin-4-yl)sulfanyl-propanamide Openeye Name: (2S)-2-(2-methyl-6-phenyl-pyrimidin-4-yl)sulfanyl-N-(o-tolyl)propanamide CAS Name: (2S)-N-(2-methylphenyl)-2-[(2-methyl-6-phenyl-4-pyrimidinyl)thio]propanamide IUPAC Name: (2S)-N-(2-methylphenyl)-2-(2-methyl-6-phenylpyrimidin-4-yl)sulfanylpropanamide Traditional Name: (2S)-2-[(2-methyl-6-phenyl-pyrimidin-4-yl)thio]-N-(o-tolyl)propionamide Formula: C21H21N3OS MolecularWeight: 363.47594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)C(C)SC2=NC(=NC(=C2)C3=CC=CC=C3)C

Isomeric SMILES

CC1=CC=CC=C1NC(=O)[C@H](C)SC2=NC(=NC(=C2)C3=CC=CC=C3)C

InChI

InChI=1S/C21H21N3OS/c1-14-9-7-8-12-18(14)24-21(25)15(2)26-20-13-19(22-16(3)23-20)17-10-5-4-6-11-17/h4-13,15H,1-3H3,(H,24,25)/t15-/m0/s1