N-[2,4-bis(fluoranyl)phenyl]-2-[(3-bromophenyl)methylsulfanyl]propanamide

Systemtic Name: N-[2,4-bis(fluoranyl)phenyl]-2-[(3-bromophenyl)methylsulfanyl]propanamide Openeye Name: 2-[(3-bromophenyl)methylsulfanyl]-N-(2,4-difluorophenyl)propanamide CAS Name: 2-[(3-bromophenyl)methylthio]-N-(2,4-difluorophenyl)propanamide IUPAC Name: 2-[(3-bromophenyl)methylsulfanyl]-N-(2,4-difluorophenyl)propanamide Traditional Name: 2-[(3-bromobenzyl)thio]-N-(2,4-difluorophenyl)propionamide Formula: C16H14BrF2NOS MolecularWeight: 386.254266

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=C(C=C1)F)F)SCC2=CC(=CC=C2)Br

Isomeric SMILES

CC(C(=O)NC1=C(C=C(C=C1)F)F)SCC2=CC(=CC=C2)Br

InChI

InChI=1S/C16H14BrF2NOS/c1-10(22-9-11-3-2-4-12(17)7-11)16(21)20-15-6-5-13(18)8-14(15)19/h2-8,10H,9H2,1H3,(H,20,21)