N-[3,4-bis(fluoranyl)phenyl]-2-[(3-bromanyl-4-methoxy-phenyl)methylsulfanyl]ethanamide

Systemtic Name: N-[3,4-bis(fluoranyl)phenyl]-2-[(3-bromanyl-4-methoxy-phenyl)methylsulfanyl]ethanamide Openeye Name: 2-[(3-bromo-4-methoxy-phenyl)methylsulfanyl]-N-(3,4-difluorophenyl)acetamide CAS Name: 2-[(3-bromo-4-methoxyphenyl)methylthio]-N-(3,4-difluorophenyl)acetamide IUPAC Name: 2-[(3-bromo-4-methoxyphenyl)methylsulfanyl]-N-(3,4-difluorophenyl)acetamide Traditional Name: 2-[(3-bromo-4-methoxy-benzyl)thio]-N-(3,4-difluorophenyl)acetamide Formula: C16H14BrF2NO2S MolecularWeight: 402.253666

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CSCC(=O)NC2=CC(=C(C=C2)F)F)Br

Isomeric SMILES

COC1=C(C=C(C=C1)CSCC(=O)NC2=CC(=C(C=C2)F)F)Br

InChI

InChI=1S/C16H14BrF2NO2S/c1-22-15-5-2-10(6-12(15)17)8-23-9-16(21)20-11-3-4-13(18)14(19)7-11/h2-7H,8-9H2,1H3,(H,20,21)