(E)-2-cyclopropylcarbonyl-3-[(2-fluorophenyl)amino]sulfanyl-3-oxidanyl-prop-2-enenitrile

Systemtic Name: (E)-2-cyclopropylcarbonyl-3-[(2-fluorophenyl)amino]sulfanyl-3-oxidanyl-prop-2-enenitrile Openeye Name: (E)-2-(cyclopropanecarbonyl)-3-(2-fluoroanilino)sulfanyl-3-hydroxy-prop-2-enenitrile CAS Name: (E)-2-cyano-3-cyclopropyl-N-(2-fluorophenyl)-1-hydroxy-3-oxo-1-propene-1-sulfenamide IUPAC Name: (E)-2-(cyclopropanecarbonyl)-3-(2-fluoroanilino)sulfanyl-3-hydroxyprop-2-enenitrile Traditional Name: (E)-2-(cyclopropanecarbonyl)-3-[(2-fluoroanilino)thio]-3-hydroxy-acrylonitrile Formula: C13H11FN2O2S MolecularWeight: 278.302043

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)C(=C(O)SNC2=CC=CC=C2F)C#N

Isomeric SMILES

C1CC1C(=O)/C(=C(\O)/SNC2=CC=CC=C2F)/C#N

InChI

InChI=1S/C13H11FN2O2S/c14-10-3-1-2-4-11(10)16-19-13(18)9(7-15)12(17)8-5-6-8/h1-4,8,16,18H,5-6H2/b13-9+