1-(2-azanyl-1,3-benzothiazol-6-yl)-2,2,2-tris(fluoranyl)ethanone

Systemtic Name: 1-(2-azanyl-1,3-benzothiazol-6-yl)-2,2,2-tris(fluoranyl)ethanone Openeye Name: 1-(2-amino-1,3-benzothiazol-6-yl)-2,2,2-trifluoro-ethanone CAS Name: 1-(2-amino-1,3-benzothiazol-6-yl)-2,2,2-trifluoroethanone IUPAC Name: 1-(2-amino-1,3-benzothiazol-6-yl)-2,2,2-trifluoroethanone Traditional Name: 1-(2-amino-1,3-benzothiazol-6-yl)-2,2,2-trifluoro-ethanone Formula: C9H5F3N2OS MolecularWeight: 246.20901

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1C(=O)C(F)(F)F)SC(=N2)N

Isomeric SMILES

C1=CC2=C(C=C1C(=O)C(F)(F)F)SC(=N2)N

InChI

InChI=1S/C9H5F3N2OS/c10-9(11,12)7(15)4-1-2-5-6(3-4)16-8(13)14-5/h1-3H,(H2,13,14)