2-acetamido-3-(4-bromanylbutanoylsulfanyl)propanoic acid

Systemtic Name: 2-acetamido-3-(4-bromanylbutanoylsulfanyl)propanoic acid Openeye Name: 2-acetamido-3-(4-bromobutanoylsulfanyl)propanoic acid CAS Name: 2-acetamido-3-[(4-bromo-1-oxobutyl)thio]propanoic acid IUPAC Name: 2-acetamido-3-(4-bromobutanoylsulfanyl)propanoic acid Traditional Name: 2-acetamido-3-(4-bromobutanoylthio)propionic acid Formula: C9H14BrNO4S MolecularWeight: 312.18076

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CSC(=O)CCCBr)C(=O)O

Isomeric SMILES

CC(=O)NC(CSC(=O)CCCBr)C(=O)O

InChI

InChI=1S/C9H14BrNO4S/c1-6(12)11-7(9(14)15)5-16-8(13)3-2-4-10/h7H,2-5H2,1H3,(H,11,12)(H,14,15)