3-[4-(2,5-dimethyl-1,3-thiazol-4-yl)phenyl]propanoic acid

Systemtic Name: 3-[4-(2,5-dimethyl-1,3-thiazol-4-yl)phenyl]propanoic acid Openeye Name: 3-[4-(2,5-dimethylthiazol-4-yl)phenyl]propanoic acid CAS Name: 3-[4-(2,5-dimethyl-4-thiazolyl)phenyl]propanoic acid IUPAC Name: 3-[4-(2,5-dimethyl-1,3-thiazol-4-yl)phenyl]propanoic acid Traditional Name: 3-[4-(2,5-dimethylthiazol-4-yl)phenyl]propionic acid Formula: C14H15NO2S MolecularWeight: 261.3394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(S1)C)C2=CC=C(C=C2)CCC(=O)O

Isomeric SMILES

CC1=C(N=C(S1)C)C2=CC=C(C=C2)CCC(=O)O

InChI

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