1-[(4R)-1-(1,3-benzothiazol-2-yl)-5-oxidanylidene-3-(trifluoromethyl)-4H-pyrazol-4-yl]ethenylcyanamide

Systemtic Name: 1-[(4R)-1-(1,3-benzothiazol-2-yl)-5-oxidanylidene-3-(trifluoromethyl)-4H-pyrazol-4-yl]ethenylcyanamide Openeye Name: 1-[(4R)-1-(1,3-benzothiazol-2-yl)-5-oxo-3-(trifluoromethyl)-4H-pyrazol-4-yl]vinylcyanamide CAS Name: 1-[(4R)-1-(1,3-benzothiazol-2-yl)-5-oxo-3-(trifluoromethyl)-4H-pyrazol-4-yl]ethenylcyanamide IUPAC Name: 1-[(4R)-1-(1,3-benzothiazol-2-yl)-5-oxo-3-(trifluoromethyl)-4H-pyrazol-4-yl]ethenylcyanamide Traditional Name: 1-[(4R)-1-(1,3-benzothiazol-2-yl)-5-keto-3-(trifluoromethyl)-2-pyrazolin-4-yl]vinylcyanamide Formula: C14H8F3N5OS MolecularWeight: 351.30643

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Descriptors Computed from Structure

Canonical SMILES:

C=C(C1C(=NN(C1=O)C2=NC3=CC=CC=C3S2)C(F)(F)F)NC#N

Isomeric SMILES

C=C([C@@H]1C(=NN(C1=O)C2=NC3=CC=CC=C3S2)C(F)(F)F)NC#N

InChI

InChI=1S/C14H8F3N5OS/c1-7(19-6-18)10-11(14(15,16)17)21-22(12(10)23)13-20-8-4-2-3-5-9(8)24-13/h2-5,10,19H,1H2/t10-/m1/s1