(2S)-2-azanyl-3-[(5-bromanyl-2-fluoranyl-phenyl)methylsulfanyl]propanoic acid

Systemtic Name: (2S)-2-azanyl-3-[(5-bromanyl-2-fluoranyl-phenyl)methylsulfanyl]propanoic acid Openeye Name: (2S)-2-amino-3-[(5-bromo-2-fluoro-phenyl)methylsulfanyl]propanoic acid CAS Name: (2S)-2-amino-3-[(5-bromo-2-fluorophenyl)methylthio]propanoic acid IUPAC Name: (2S)-2-amino-3-[(5-bromo-2-fluorophenyl)methylsulfanyl]propanoic acid Traditional Name: (2S)-2-amino-3-[(5-bromo-2-fluoro-benzyl)thio]propionic acid Formula: C10H11BrFNO2S MolecularWeight: 308.167243

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Br)CSCC(C(=O)O)N)F

Isomeric SMILES

C1=CC(=C(C=C1Br)CSC[C@H](C(=O)O)N)F

InChI

InChI=1S/C10H11BrFNO2S/c11-7-1-2-8(12)6(3-7)4-16-5-9(13)10(14)15/h1-3,9H,4-5,13H2,(H,14,15)/t9-/m1/s1