3-(2-methyl-1,3-thiazol-4-yl)-3-oxidanylidene-2-phenyl-propanoic acid

Systemtic Name: 3-(2-methyl-1,3-thiazol-4-yl)-3-oxidanylidene-2-phenyl-propanoic acid Openeye Name: 3-(2-methylthiazol-4-yl)-3-oxo-2-phenyl-propanoic acid CAS Name: 3-(2-methyl-4-thiazolyl)-3-oxo-2-phenylpropanoic acid IUPAC Name: 3-(2-methyl-1,3-thiazol-4-yl)-3-oxo-2-phenylpropanoic acid Traditional Name: 3-keto-3-(2-methylthiazol-4-yl)-2-phenyl-propionic acid Formula: C13H11NO3S MolecularWeight: 261.29634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)C(=O)C(C2=CC=CC=C2)C(=O)O

Isomeric SMILES

CC1=NC(=CS1)C(=O)C(C2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C13H11NO3S/c1-8-14-10(7-18-8)12(15)11(13(16)17)9-5-3-2-4-6-9/h2-7,11H,1H3,(H,16,17)