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2-[(5-cyano-2-fluoranyl-phenyl)methylsulfanyl]ethanoic acid

2-[(5-cyano-2-fluoranyl-phenyl)methylsulfanyl]ethanoic acid

Systemtic Name:2-[(5-cyano-2-fluoranyl-phenyl)methylsulfanyl]ethanoic acid
Openeye Name:2-[(5-cyano-2-fluoro-phenyl)methylsulfanyl]acetic acid
CAS Name:2-[(5-cyano-2-fluorophenyl)methylthio]acetic acid
IUPAC Name:2-[(5-cyano-2-fluorophenyl)methylsulfanyl]acetic acid
Traditional Name:2-[(5-cyano-2-fluoro-benzyl)thio]acetic acid
Formula: C10H8FNO2S
MolecularWeight: 225.239423
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C#N)CSCC(=O)O)F


Isomeric SMILES

C1=CC(=C(C=C1C#N)CSCC(=O)O)F


InChI

InChI=1S/C10H8FNO2S/c11-9-2-1-7(4-12)3-8(9)5-15-6-10(13)14/h1-3H,5-6H2,(H,13,14)


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