2-[4-(4-methylphenyl)-2-pyridin-2-yl-1,3-thiazol-5-yl]ethanoic acid hydrobromide

Systemtic Name: 2-[4-(4-methylphenyl)-2-pyridin-2-yl-1,3-thiazol-5-yl]ethanoic acid hydrobromide Openeye Name: 2-[4-(p-tolyl)-2-(2-pyridyl)thiazol-5-yl]acetic acid hydrobromide CAS Name: 2-[4-(4-methylphenyl)-2-(2-pyridinyl)-5-thiazolyl]acetic acid hydrobromide IUPAC Name: 2-[4-(4-methylphenyl)-2-pyridin-2-yl-1,3-thiazol-5-yl]acetic acid hydrobromide Traditional Name: 2-[4-(p-tolyl)-2-(2-pyridyl)thiazol-5-yl]acetic acid hydrobromide Formula: C17H15BrN2O2S MolecularWeight: 391.2822

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(SC(=N2)C3=CC=CC=N3)CC(=O)O.Br

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(SC(=N2)C3=CC=CC=N3)CC(=O)O.Br

InChI

InChI=1S/C17H14N2O2S.BrH/c1-11-5-7-12(8-6-11)16-14(10-15(20)21)22-17(19-16)13-4-2-3-9-18-13;/h2-9H,10H2,1H3,(H,20,21);1H