2-acetamido-3-prop-2-enoylsulfanyl-propanoic acid

Systemtic Name: 2-acetamido-3-prop-2-enoylsulfanyl-propanoic acid Openeye Name: 2-acetamido-3-prop-2-enoylsulfanyl-propanoic acid CAS Name: 2-acetamido-3-(1-oxoprop-2-enylthio)propanoic acid IUPAC Name: 2-acetamido-3-prop-2-enoylsulfanylpropanoic acid Traditional Name: 2-acetamido-3-(acryloylthio)propionic acid Formula: C8H11NO4S MolecularWeight: 217.24224

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H11NO4S/c1-3-7(11)14-4-6(8(12)13)9-5(2)10/h3,6H,1,4H2,2H3,(H,9,10)(H,12,13)