2-bromanyl-2-[2-(5-methyl-2-phenyl-1,3-thiazol-4-yl)ethoxy]-3-pyridin-3-yl-propanoic acid

Systemtic Name: 2-bromanyl-2-[2-(5-methyl-2-phenyl-1,3-thiazol-4-yl)ethoxy]-3-pyridin-3-yl-propanoic acid Openeye Name: 2-bromo-2-[2-(5-methyl-2-phenyl-thiazol-4-yl)ethoxy]-3-(3-pyridyl)propanoic acid CAS Name: 2-bromo-2-[2-(5-methyl-2-phenyl-4-thiazolyl)ethoxy]-3-(3-pyridinyl)propanoic acid IUPAC Name: 2-bromo-2-[2-(5-methyl-2-phenyl-1,3-thiazol-4-yl)ethoxy]-3-pyridin-3-ylpropanoic acid Traditional Name: 2-bromo-2-[2-(5-methyl-2-phenyl-thiazol-4-yl)ethoxy]-3-(3-pyridyl)propionic acid Formula: C20H19BrN2O3S MolecularWeight: 447.34546

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(S1)C2=CC=CC=C2)CCOC(CC3=CN=CC=C3)(C(=O)O)Br

Isomeric SMILES

CC1=C(N=C(S1)C2=CC=CC=C2)CCOC(CC3=CN=CC=C3)(C(=O)O)Br

InChI

InChI=1S/C20H19BrN2O3S/c1-14-17(23-18(27-14)16-7-3-2-4-8-16)9-11-26-20(21,19(24)25)12-15-6-5-10-22-13-15/h2-8,10,13H,9,11-12H2,1H3,(H,24,25)