ethyl (2Z)-2-[1,1-bis(oxidanylidene)-2-[[4-(trifluoromethyl)phenyl]methyl]-1,2-benzothiazol-3-ylidene]-2-cyano-ethanoate

Systemtic Name: ethyl (2Z)-2-[1,1-bis(oxidanylidene)-2-[[4-(trifluoromethyl)phenyl]methyl]-1,2-benzothiazol-3-ylidene]-2-cyano-ethanoate Openeye Name: ethyl (2Z)-2-cyano-2-[1,1-dioxo-2-[[4-(trifluoromethyl)phenyl]methyl]-1,2-benzothiazol-3-ylidene]acetate CAS Name: (2Z)-2-cyano-2-[1,1-dioxo-2-[[4-(trifluoromethyl)phenyl]methyl]-1,2-benzothiazol-3-ylidene]acetic acid ethyl ester IUPAC Name: ethyl (2Z)-2-cyano-2-[1,1-dioxo-2-[[4-(trifluoromethyl)phenyl]methyl]-1,2-benzothiazol-3-ylidene]acetate Traditional Name: (2Z)-2-cyano-2-[1,1-diketo-2-[4-(trifluoromethyl)benzyl]-1,2-benzothiazol-3-ylidene]acetic acid ethyl ester Formula: C20H15F3N2O4S MolecularWeight: 436.40431

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C1C2=CC=CC=C2S(=O)(=O)N1CC3=CC=C(C=C3)C(F)(F)F)C#N

Isomeric SMILES

CCOC(=O)/C(=C\1/C2=CC=CC=C2S(=O)(=O)N1CC3=CC=C(C=C3)C(F)(F)F)/C#N

InChI

InChI=1S/C20H15F3N2O4S/c1-2-29-19(26)16(11-24)18-15-5-3-4-6-17(15)30(27,28)25(18)12-13-7-9-14(10-8-13)20(21,22)23/h3-10H,2,12H2,1H3/b18-16-