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

Systemtic Name: cyclopropyl 2-(2-chloranyl-4-fluoranyl-5-isothiocyanato-phenyl)sulfanylethanoate Openeye Name: cyclopropyl 2-(2-chloro-4-fluoro-5-isothiocyanato-phenyl)sulfanylacetate CAS Name: 2-[(2-chloro-4-fluoro-5-isothiocyanatophenyl)thio]acetic acid cyclopropyl ester IUPAC Name: cyclopropyl 2-(2-chloro-4-fluoro-5-isothiocyanatophenyl)sulfanylacetate Traditional Name: 2-[(2-chloro-4-fluoro-5-isothiocyanato-phenyl)thio]acetic acid cyclopropyl ester Formula: C12H9ClFNO2S2 MolecularWeight: 317.786763

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1OC(=O)CSC2=C(C=C(C(=C2)N=C=S)F)Cl

Isomeric SMILES

C1CC1OC(=O)CSC2=C(C=C(C(=C2)N=C=S)F)Cl

InChI

InChI=1S/C12H9ClFNO2S2/c13-8-3-9(14)10(15-6-18)4-11(8)19-5-12(16)17-7-1-2-7/h3-4,7H,1-2,5H2