3-(2-chloranylpyridin-3-yl)-3-oxidanylidene-2-[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]propanenitrile

Systemtic Name: 3-(2-chloranylpyridin-3-yl)-3-oxidanylidene-2-[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]propanenitrile Openeye Name: 3-(2-chloro-3-pyridyl)-3-oxo-2-[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]propanenitrile CAS Name: 3-(2-chloro-3-pyridinyl)-3-oxo-2-[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]propanenitrile IUPAC Name: 3-(2-chloropyridin-3-yl)-3-oxo-2-[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]propanenitrile Traditional Name: 3-(2-chloro-3-pyridyl)-3-keto-2-[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]propionitrile Formula: C16H7ClF3N3OS MolecularWeight: 381.75949

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)Cl)C(=O)C(C#N)C2=NC3=C(S2)C=CC(=C3)C(F)(F)F

Isomeric SMILES

C1=CC(=C(N=C1)Cl)C(=O)C(C#N)C2=NC3=C(S2)C=CC(=C3)C(F)(F)F

InChI

InChI=1S/C16H7ClF3N3OS/c17-14-9(2-1-5-22-14)13(24)10(7-21)15-23-11-6-8(16(18,19)20)3-4-12(11)25-15/h1-6,10H