2-[[(E)-3-(2-methyl-1,3-thiazol-4-yl)prop-2-enoyl]amino]-3-oxidanyl-propanoic acid

Systemtic Name: 2-[[(E)-3-(2-methyl-1,3-thiazol-4-yl)prop-2-enoyl]amino]-3-oxidanyl-propanoic acid Openeye Name: 3-hydroxy-2-[[(E)-3-(2-methylthiazol-4-yl)prop-2-enoyl]amino]propanoic acid CAS Name: 3-hydroxy-2-[[(E)-3-(2-methyl-4-thiazolyl)-1-oxoprop-2-enyl]amino]propanoic acid IUPAC Name: 3-hydroxy-2-[[(E)-3-(2-methyl-1,3-thiazol-4-yl)prop-2-enoyl]amino]propanoic acid Traditional Name: 3-hydroxy-2-[[(E)-3-(2-methylthiazol-4-yl)acryloyl]amino]propionic acid Formula: C10H12N2O4S MolecularWeight: 256.27828

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H12N2O4S/c1-6-11-7(5-17-6)2-3-9(14)12-8(4-13)10(15)16/h2-3,5,8,13H,4H2,1H3,(H,12,14)(H,15,16)/b3-2+