ethyl 2-cyano-3-(2-ethoxy-2-oxidanylidene-ethyl)sulfanyl-3-[[2-(trifluoromethyl)phenyl]amino]prop-2-enoate

Systemtic Name: ethyl 2-cyano-3-(2-ethoxy-2-oxidanylidene-ethyl)sulfanyl-3-[[2-(trifluoromethyl)phenyl]amino]prop-2-enoate Openeye Name: ethyl 2-cyano-3-(2-ethoxy-2-oxo-ethyl)sulfanyl-3-[2-(trifluoromethyl)anilino]prop-2-enoate CAS Name: 2-cyano-3-[(2-ethoxy-2-oxoethyl)thio]-3-[2-(trifluoromethyl)anilino]-2-propenoic acid ethyl ester IUPAC Name: ethyl 2-cyano-3-(2-ethoxy-2-oxoethyl)sulfanyl-3-[2-(trifluoromethyl)anilino]prop-2-enoate Traditional Name: 2-cyano-3-[(2-ethoxy-2-keto-ethyl)thio]-3-[2-(trifluoromethyl)anilino]acrylic acid ethyl ester Formula: C17H17F3N2O4S MolecularWeight: 402.38809

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC(=C(C#N)C(=O)OCC)NC1=CC=CC=C1C(F)(F)F

Isomeric SMILES

CCOC(=O)CSC(=C(C#N)C(=O)OCC)NC1=CC=CC=C1C(F)(F)F

InChI

InChI=1S/C17H17F3N2O4S/c1-3-25-14(23)10-27-15(11(9-21)16(24)26-4-2)22-13-8-6-5-7-12(13)17(18,19)20/h5-8,22H,3-4,10H2,1-2H3