2-[(3-acetamido-3-thiophen-2-yl-propanoyl)amino]-3-oxidanyl-propanoic acid

Systemtic Name: 2-[(3-acetamido-3-thiophen-2-yl-propanoyl)amino]-3-oxidanyl-propanoic acid Openeye Name: 2-[[3-acetamido-3-(2-thienyl)propanoyl]amino]-3-hydroxy-propanoic acid CAS Name: 2-[(3-acetamido-1-oxo-3-thiophen-2-ylpropyl)amino]-3-hydroxypropanoic acid IUPAC Name: 2-[(3-acetamido-3-thiophen-2-ylpropanoyl)amino]-3-hydroxypropanoic acid Traditional Name: 2-[[3-acetamido-3-(2-thienyl)propanoyl]amino]-3-hydroxy-propionic acid Formula: C12H16N2O5S MolecularWeight: 300.33084

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16N2O5S/c1-7(16)13-8(10-3-2-4-20-10)5-11(17)14-9(6-15)12(18)19/h2-4,8-9,15H,5-6H2,1H3,(H,13,16)(H,14,17)(H,18,19)