2-[2-(2-methyl-1,3-thiazol-4-yl)ethanoylamino]-3-oxidanyl-propanoic acid

Systemtic Name: 2-[2-(2-methyl-1,3-thiazol-4-yl)ethanoylamino]-3-oxidanyl-propanoic acid Openeye Name: 3-hydroxy-2-[[2-(2-methylthiazol-4-yl)acetyl]amino]propanoic acid CAS Name: 3-hydroxy-2-[[2-(2-methyl-4-thiazolyl)-1-oxoethyl]amino]propanoic acid IUPAC Name: 3-hydroxy-2-[[2-(2-methyl-1,3-thiazol-4-yl)acetyl]amino]propanoic acid Traditional Name: 3-hydroxy-2-[[2-(2-methylthiazol-4-yl)acetyl]amino]propionic acid Formula: C9H12N2O4S MolecularWeight: 244.26758

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)CC(=O)NC(CO)C(=O)O

Isomeric SMILES

CC1=NC(=CS1)CC(=O)NC(CO)C(=O)O

InChI

InChI=1S/C9H12N2O4S/c1-5-10-6(4-16-5)2-8(13)11-7(3-12)9(14)15/h4,7,12H,2-3H2,1H3,(H,11,13)(H,14,15)