(2S)-N-(2,4-dimethylphenyl)-2-(4,5,6-trimethylpyrimidin-2-yl)sulfanyl-propanamide

Systemtic Name: (2S)-N-(2,4-dimethylphenyl)-2-(4,5,6-trimethylpyrimidin-2-yl)sulfanyl-propanamide Openeye Name: (2S)-N-(2,4-dimethylphenyl)-2-(4,5,6-trimethylpyrimidin-2-yl)sulfanyl-propanamide CAS Name: (2S)-N-(2,4-dimethylphenyl)-2-[(4,5,6-trimethyl-2-pyrimidinyl)thio]propanamide IUPAC Name: (2S)-N-(2,4-dimethylphenyl)-2-(4,5,6-trimethylpyrimidin-2-yl)sulfanylpropanamide Traditional Name: (2S)-N-(2,4-dimethylphenyl)-2-[(4,5,6-trimethylpyrimidin-2-yl)thio]propionamide Formula: C18H23N3OS MolecularWeight: 329.45972

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H23N3OS/c1-10-7-8-16(11(2)9-10)21-17(22)15(6)23-18-19-13(4)12(3)14(5)20-18/h7-9,15H,1-6H3,(H,21,22)/t15-/m0/s1