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

Systemtic Name: (2S)-N-(4-chloranyl-2-fluoranyl-phenyl)-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-propanamide Openeye Name: (2S)-N-(4-chloro-2-fluoro-phenyl)-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-propanamide CAS Name: (2S)-N-(4-chloro-2-fluorophenyl)-2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]propanamide IUPAC Name: (2S)-N-(4-chloro-2-fluorophenyl)-2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanylpropanamide Traditional Name: (2S)-N-(4-chloro-2-fluoro-phenyl)-2-[(4-methyl-6-phenyl-pyrimidin-2-yl)thio]propionamide Formula: C20H17ClFN3OS MolecularWeight: 401.884883

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=C1)C2=CC=CC=C2)SC(C)C(=O)NC3=C(C=C(C=C3)Cl)F

Isomeric SMILES

CC1=NC(=NC(=C1)C2=CC=CC=C2)S[C@@H](C)C(=O)NC3=C(C=C(C=C3)Cl)F

InChI

InChI=1S/C20H17ClFN3OS/c1-12-10-18(14-6-4-3-5-7-14)25-20(23-12)27-13(2)19(26)24-17-9-8-15(21)11-16(17)22/h3-11,13H,1-2H3,(H,24,26)/t13-/m0/s1