cyclopropyl 2-(2-chloranyl-4-fluoranyl-5-isothiocyanato-phenyl)sulfanylpropanoate

Systemtic Name: cyclopropyl 2-(2-chloranyl-4-fluoranyl-5-isothiocyanato-phenyl)sulfanylpropanoate Openeye Name: cyclopropyl 2-(2-chloro-4-fluoro-5-isothiocyanato-phenyl)sulfanylpropanoate CAS Name: 2-[(2-chloro-4-fluoro-5-isothiocyanatophenyl)thio]propanoic acid cyclopropyl ester IUPAC Name: cyclopropyl 2-(2-chloro-4-fluoro-5-isothiocyanatophenyl)sulfanylpropanoate Traditional Name: 2-[(2-chloro-4-fluoro-5-isothiocyanato-phenyl)thio]propionic acid cyclopropyl ester Formula: C13H11ClFNO2S2 MolecularWeight: 331.813343

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC1CC1)SC2=C(C=C(C(=C2)N=C=S)F)Cl

Isomeric SMILES

CC(C(=O)OC1CC1)SC2=C(C=C(C(=C2)N=C=S)F)Cl

InChI

InChI=1S/C13H11ClFNO2S2/c1-7(13(17)18-8-2-3-8)20-12-5-11(16-6-19)10(15)4-9(12)14/h4-5,7-8H,2-3H2,1H3