(2S)-2-[(4-bromophenyl)methylsulfanyl]-N-(5-fluoranyl-2-methyl-phenyl)propanamide

Systemtic Name: (2S)-2-[(4-bromophenyl)methylsulfanyl]-N-(5-fluoranyl-2-methyl-phenyl)propanamide Openeye Name: (2S)-2-[(4-bromophenyl)methylsulfanyl]-N-(5-fluoro-2-methyl-phenyl)propanamide CAS Name: (2S)-2-[(4-bromophenyl)methylthio]-N-(5-fluoro-2-methylphenyl)propanamide IUPAC Name: (2S)-2-[(4-bromophenyl)methylsulfanyl]-N-(5-fluoro-2-methylphenyl)propanamide Traditional Name: (2S)-2-[(4-bromobenzyl)thio]-N-(5-fluoro-2-methyl-phenyl)propionamide Formula: C17H17BrFNOS MolecularWeight: 382.290383

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)F)NC(=O)C(C)SCC2=CC=C(C=C2)Br

Isomeric SMILES

CC1=C(C=C(C=C1)F)NC(=O)[C@H](C)SCC2=CC=C(C=C2)Br

InChI

InChI=1S/C17H17BrFNOS/c1-11-3-8-15(19)9-16(11)20-17(21)12(2)22-10-13-4-6-14(18)7-5-13/h3-9,12H,10H2,1-2H3,(H,20,21)/t12-/m0/s1