2-[(2-bromanyl-4-fluoranyl-phenyl)carbonylamino]-3-sulfanyl-propanoic acid

Systemtic Name: 2-[(2-bromanyl-4-fluoranyl-phenyl)carbonylamino]-3-sulfanyl-propanoic acid Openeye Name: 2-[(2-bromo-4-fluoro-benzoyl)amino]-3-sulfanyl-propanoic acid CAS Name: 2-[[(2-bromo-4-fluorophenyl)-oxomethyl]amino]-3-mercaptopropanoic acid IUPAC Name: 2-[(2-bromo-4-fluorobenzoyl)amino]-3-sulfanylpropanoic acid Traditional Name: 2-[(2-bromo-4-fluoro-benzoyl)amino]-3-mercapto-propionic acid Formula: C10H9BrFNO3S MolecularWeight: 322.150763

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1F)Br)C(=O)NC(CS)C(=O)O

Isomeric SMILES

C1=CC(=C(C=C1F)Br)C(=O)NC(CS)C(=O)O

InChI

InChI=1S/C10H9BrFNO3S/c11-7-3-5(12)1-2-6(7)9(14)13-8(4-17)10(15)16/h1-3,8,17H,4H2,(H,13,14)(H,15,16)