4-[2-(3-fluoranyl-4-pyridin-3-yl-phenyl)ethynyl]-2-methyl-1,3-thiazole hydrobromide

Systemtic Name: 4-[2-(3-fluoranyl-4-pyridin-3-yl-phenyl)ethynyl]-2-methyl-1,3-thiazole hydrobromide Openeye Name: 4-[2-[3-fluoro-4-(3-pyridyl)phenyl]ethynyl]-2-methyl-thiazole hydrobromide CAS Name: 4-[2-[3-fluoro-4-(3-pyridinyl)phenyl]ethynyl]-2-methylthiazole hydrobromide IUPAC Name: 4-[2-(3-fluoro-4-pyridin-3-ylphenyl)ethynyl]-2-methyl-1,3-thiazole hydrobromide Traditional Name: 4-[2-[3-fluoro-4-(3-pyridyl)phenyl]ethynyl]-2-methyl-thiazole hydrobromide Formula: C17H12BrFN2S MolecularWeight: 375.257983

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)C#CC2=CC(=C(C=C2)C3=CN=CC=C3)F.Br

Isomeric SMILES

CC1=NC(=CS1)C#CC2=CC(=C(C=C2)C3=CN=CC=C3)F.Br

InChI

InChI=1S/C17H11FN2S.BrH/c1-12-20-15(11-21-12)6-4-13-5-7-16(17(18)9-13)14-3-2-8-19-10-14;/h2-3,5,7-11H,1H3;1H