3-[2-[(5-bromanylpyridin-2-yl)amino]-2-oxidanylidene-ethyl]sulfanylpropanoic acid

Systemtic Name: 3-[2-[(5-bromanylpyridin-2-yl)amino]-2-oxidanylidene-ethyl]sulfanylpropanoic acid Openeye Name: 3-[2-[(5-bromo-2-pyridyl)amino]-2-oxo-ethyl]sulfanylpropanoic acid CAS Name: 3-[[2-[(5-bromo-2-pyridinyl)amino]-2-oxoethyl]thio]propanoic acid IUPAC Name: 3-[2-[(5-bromopyridin-2-yl)amino]-2-oxoethyl]sulfanylpropanoic acid Traditional Name: 3-[[2-[(5-bromo-2-pyridyl)amino]-2-keto-ethyl]thio]propionic acid Formula: C10H11BrN2O3S MolecularWeight: 319.17494

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=NC=C1Br)NC(=O)CSCCC(=O)O

Isomeric SMILES

C1=CC(=NC=C1Br)NC(=O)CSCCC(=O)O

InChI

InChI=1S/C10H11BrN2O3S/c11-7-1-2-8(12-5-7)13-9(14)6-17-4-3-10(15)16/h1-2,5H,3-4,6H2,(H,15,16)(H,12,13,14)