2-[(3-bromanyl-4-fluoranyl-phenyl)methylsulfanyl]ethanamine

Systemtic Name: 2-[(3-bromanyl-4-fluoranyl-phenyl)methylsulfanyl]ethanamine Openeye Name: 2-[(3-bromo-4-fluoro-phenyl)methylsulfanyl]ethanamine CAS Name: 2-[(3-bromo-4-fluorophenyl)methylthio]ethanamine IUPAC Name: 2-[(3-bromo-4-fluorophenyl)methylsulfanyl]ethanamine Traditional Name: 2-[(3-bromo-4-fluoro-benzyl)thio]ethylamine Formula: C9H11BrFNS MolecularWeight: 264.157743

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1CSCCN)Br)F

Isomeric SMILES

C1=CC(=C(C=C1CSCCN)Br)F

InChI

InChI=1S/C9H11BrFNS/c10-8-5-7(1-2-9(8)11)6-13-4-3-12/h1-2,5H,3-4,6,12H2