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

Systemtic Name: cyclopentyl 2-(2-chloranyl-4-fluoranyl-5-isothiocyanato-phenyl)sulfanylpropanoate Openeye Name: cyclopentyl 2-(2-chloro-4-fluoro-5-isothiocyanato-phenyl)sulfanylpropanoate CAS Name: 2-[(2-chloro-4-fluoro-5-isothiocyanatophenyl)thio]propanoic acid cyclopentyl ester IUPAC Name: cyclopentyl 2-(2-chloro-4-fluoro-5-isothiocyanatophenyl)sulfanylpropanoate Traditional Name: 2-[(2-chloro-4-fluoro-5-isothiocyanato-phenyl)thio]propionic acid cyclopentyl ester Formula: C15H15ClFNO2S2 MolecularWeight: 359.866503

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC1CCCC1)SC2=C(C=C(C(=C2)N=C=S)F)Cl

Isomeric SMILES

CC(C(=O)OC1CCCC1)SC2=C(C=C(C(=C2)N=C=S)F)Cl

InChI

InChI=1S/C15H15ClFNO2S2/c1-9(15(19)20-10-4-2-3-5-10)22-14-7-13(18-8-21)12(17)6-11(14)16/h6-7,9-10H,2-5H2,1H3