N-[6-[bis(fluoranyl)methylsulfanyl]-1,3-benzothiazol-2-yl]-5-bromanyl-pyridine-3-carboxamide

Systemtic Name: N-[6-[bis(fluoranyl)methylsulfanyl]-1,3-benzothiazol-2-yl]-5-bromanyl-pyridine-3-carboxamide Openeye Name: 5-bromo-N-[6-(difluoromethylsulfanyl)-1,3-benzothiazol-2-yl]pyridine-3-carboxamide CAS Name: 5-bromo-N-[6-(difluoromethylthio)-1,3-benzothiazol-2-yl]-3-pyridinecarboxamide IUPAC Name: 5-bromo-N-[6-(difluoromethylsulfanyl)-1,3-benzothiazol-2-yl]pyridine-3-carboxamide Traditional Name: 5-bromo-N-[6-(difluoromethylthio)-1,3-benzothiazol-2-yl]nicotinamide Formula: C14H8BrF2N3OS2 MolecularWeight: 416.263626

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1SC(F)F)SC(=N2)NC(=O)C3=CC(=CN=C3)Br

Isomeric SMILES

C1=CC2=C(C=C1SC(F)F)SC(=N2)NC(=O)C3=CC(=CN=C3)Br

InChI

InChI=1S/C14H8BrF2N3OS2/c15-8-3-7(5-18-6-8)12(21)20-14-19-10-2-1-9(22-13(16)17)4-11(10)23-14/h1-6,13H,(H,19,20,21)