3-[4-[2-(2-pyridin-4-ylethyl)-1,3-thiazol-4-yl]phenyl]propanoic acid

Systemtic Name: 3-[4-[2-(2-pyridin-4-ylethyl)-1,3-thiazol-4-yl]phenyl]propanoic acid Openeye Name: 3-[4-[2-[2-(4-pyridyl)ethyl]thiazol-4-yl]phenyl]propanoic acid CAS Name: 3-[4-[2-(2-pyridin-4-ylethyl)-4-thiazolyl]phenyl]propanoic acid IUPAC Name: 3-[4-[2-(2-pyridin-4-ylethyl)-1,3-thiazol-4-yl]phenyl]propanoic acid Traditional Name: 3-[4-[2-[2-(4-pyridyl)ethyl]thiazol-4-yl]phenyl]propionic acid Formula: C19H18N2O2S MolecularWeight: 338.42342

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCC(=O)O)C2=CSC(=N2)CCC3=CC=NC=C3

Isomeric SMILES

C1=CC(=CC=C1CCC(=O)O)C2=CSC(=N2)CCC3=CC=NC=C3

InChI

InChI=1S/C19H18N2O2S/c22-19(23)8-4-14-1-5-16(6-2-14)17-13-24-18(21-17)7-3-15-9-11-20-12-10-15/h1-2,5-6,9-13H,3-4,7-8H2,(H,22,23)