4-fluoranyl-2-(4-pyridin-2-ylbut-3-ynyl)-1,3-benzothiazole

Systemtic Name: 4-fluoranyl-2-(4-pyridin-2-ylbut-3-ynyl)-1,3-benzothiazole Openeye Name: 4-fluoro-2-[4-(2-pyridyl)but-3-ynyl]-1,3-benzothiazole CAS Name: 4-fluoro-2-[4-(2-pyridinyl)but-3-ynyl]-1,3-benzothiazole IUPAC Name: 4-fluoro-2-(4-pyridin-2-ylbut-3-ynyl)-1,3-benzothiazole Traditional Name: 4-fluoro-2-[4-(2-pyridyl)but-3-ynyl]-1,3-benzothiazole Formula: C16H11FN2S MolecularWeight: 282.335343

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)C#CCCC2=NC3=C(C=CC=C3S2)F

Isomeric SMILES

C1=CC=NC(=C1)C#CCCC2=NC3=C(C=CC=C3S2)F

InChI

InChI=1S/C16H11FN2S/c17-13-8-5-9-14-16(13)19-15(20-14)10-2-1-6-12-7-3-4-11-18-12/h3-5,7-9,11H,2,10H2