2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-[4,5,6-tris(fluoranyl)-1,3-benzothiazol-2-yl]ethanamide

Systemtic Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-[4,5,6-tris(fluoranyl)-1,3-benzothiazol-2-yl]ethanamide Openeye Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-(4,5,6-trifluoro-1,3-benzothiazol-2-yl)acetamide CAS Name: 2-[(4,6-dimethyl-2-pyrimidinyl)thio]-N-(4,5,6-trifluoro-1,3-benzothiazol-2-yl)acetamide IUPAC Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-(4,5,6-trifluoro-1,3-benzothiazol-2-yl)acetamide Traditional Name: 2-[(4,6-dimethylpyrimidin-2-yl)thio]-N-(4,5,6-trifluoro-1,3-benzothiazol-2-yl)acetamide Formula: C15H11F3N4OS2 MolecularWeight: 384.39925

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(=O)NC2=NC3=C(S2)C=C(C(=C3F)F)F)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(=O)NC2=NC3=C(S2)C=C(C(=C3F)F)F)C

InChI

InChI=1S/C15H11F3N4OS2/c1-6-3-7(2)20-14(19-6)24-5-10(23)21-15-22-13-9(25-15)4-8(16)11(17)12(13)18/h3-4H,5H2,1-2H3,(H,21,22,23)