2-[(3-acetamido-3-thiophen-2-yl-propanoyl)-methyl-amino]ethanoic acid

Systemtic Name: 2-[(3-acetamido-3-thiophen-2-yl-propanoyl)-methyl-amino]ethanoic acid Openeye Name: 2-[[3-acetamido-3-(2-thienyl)propanoyl]-methyl-amino]acetic acid CAS Name: 2-[(3-acetamido-1-oxo-3-thiophen-2-ylpropyl)-methylamino]acetic acid IUPAC Name: 2-[(3-acetamido-3-thiophen-2-ylpropanoyl)-methylamino]acetic acid Traditional Name: 2-[[3-acetamido-3-(2-thienyl)propanoyl]-methyl-amino]acetic acid Formula: C12H16N2O4S MolecularWeight: 284.33144

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC(=O)N(C)CC(=O)O)C1=CC=CS1

Isomeric SMILES

CC(=O)NC(CC(=O)N(C)CC(=O)O)C1=CC=CS1

InChI

InChI=1S/C12H16N2O4S/c1-8(15)13-9(10-4-3-5-19-10)6-11(16)14(2)7-12(17)18/h3-5,9H,6-7H2,1-2H3,(H,13,15)(H,17,18)