3-[2-(4-ethylphenyl)-1,3-thiazol-4-yl]propanoic acid

Systemtic Name: 3-[2-(4-ethylphenyl)-1,3-thiazol-4-yl]propanoic acid Openeye Name: 3-[2-(4-ethylphenyl)thiazol-4-yl]propanoic acid CAS Name: 3-[2-(4-ethylphenyl)-4-thiazolyl]propanoic acid IUPAC Name: 3-[2-(4-ethylphenyl)-1,3-thiazol-4-yl]propanoic acid Traditional Name: 3-[2-(4-ethylphenyl)thiazol-4-yl]propionic acid Formula: C14H15NO2S MolecularWeight: 261.3394

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NC(=CS2)CCC(=O)O

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NC(=CS2)CCC(=O)O

InChI

InChI=1S/C14H15NO2S/c1-2-10-3-5-11(6-4-10)14-15-12(9-18-14)7-8-13(16)17/h3-6,9H,2,7-8H2,1H3,(H,16,17)