ethyl (Z)-3-azanyl-3-ethylsulfanyl-2-[2,4,5-tris(fluoranyl)phenyl]carbonyl-prop-2-enoate

Systemtic Name: ethyl (Z)-3-azanyl-3-ethylsulfanyl-2-[2,4,5-tris(fluoranyl)phenyl]carbonyl-prop-2-enoate Openeye Name: ethyl (Z)-3-amino-3-ethylsulfanyl-2-(2,4,5-trifluorobenzoyl)prop-2-enoate CAS Name: (Z)-3-amino-3-(ethylthio)-2-[oxo-(2,4,5-trifluorophenyl)methyl]-2-propenoic acid ethyl ester IUPAC Name: ethyl (Z)-3-amino-3-ethylsulfanyl-2-(2,4,5-trifluorobenzoyl)prop-2-enoate Traditional Name: (Z)-3-amino-3-(ethylthio)-2-(2,4,5-trifluorobenzoyl)acrylic acid ethyl ester Formula: C14H14F3NO3S MolecularWeight: 333.32607

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C(N)SCC)C(=O)C1=CC(=C(C=C1F)F)F

Isomeric SMILES

CCOC(=O)/C(=C(/N)\SCC)/C(=O)C1=CC(=C(C=C1F)F)F

InChI

InChI=1S/C14H14F3NO3S/c1-3-21-14(20)11(13(18)22-4-2)12(19)7-5-9(16)10(17)6-8(7)15/h5-6H,3-4,18H2,1-2H3/b13-11-