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ethyl (E)-2-cyano-3-[(2-fluoranyl-4-thiocyanato-phenyl)amino]prop-2-enoate

ethyl (E)-2-cyano-3-[(2-fluoranyl-4-thiocyanato-phenyl)amino]prop-2-enoate

Systemtic Name:ethyl (E)-2-cyano-3-[(2-fluoranyl-4-thiocyanato-phenyl)amino]prop-2-enoate
Openeye Name:ethyl (E)-2-cyano-3-(2-fluoro-4-thiocyanato-anilino)prop-2-enoate
CAS Name:(E)-2-cyano-3-(2-fluoro-4-thiocyanatoanilino)-2-propenoic acid ethyl ester
IUPAC Name:ethyl (E)-2-cyano-3-(2-fluoro-4-thiocyanatoanilino)prop-2-enoate
Traditional Name:(E)-2-cyano-3-(2-fluoro-4-thiocyanato-anilino)acrylic acid ethyl ester
Formula: C13H10FN3O2S
MolecularWeight: 291.300803
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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CNC1=C(C=C(C=C1)SC#N)F)C#N


Isomeric SMILES

CCOC(=O)/C(=C/NC1=C(C=C(C=C1)SC#N)F)/C#N


InChI

InChI=1S/C13H10FN3O2S/c1-2-19-13(18)9(6-15)7-17-12-4-3-10(20-8-16)5-11(12)14/h3-5,7,17H,2H2,1H3/b9-7+


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