[2,3,4,5,6-pentakis(fluoranyl)phenyl]methyl 2-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]benzoate

Systemtic Name: [2,3,4,5,6-pentakis(fluoranyl)phenyl]methyl 2-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]benzoate Openeye Name: (2,3,4,5,6-pentafluorophenyl)methyl 2-[(4-methylthiazol-2-yl)sulfanylmethyl]benzoate CAS Name: 2-[[(4-methyl-2-thiazolyl)thio]methyl]benzoic acid (2,3,4,5,6-pentafluorophenyl)methyl ester IUPAC Name: (2,3,4,5,6-pentafluorophenyl)methyl 2-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]benzoate Traditional Name: 2-[[(4-methylthiazol-2-yl)thio]methyl]benzoic acid (2,3,4,5,6-pentafluorobenzyl) ester Formula: C19H12F5NO2S2 MolecularWeight: 445.426096

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)SCC2=CC=CC=C2C(=O)OCC3=C(C(=C(C(=C3F)F)F)F)F

Isomeric SMILES

CC1=CSC(=N1)SCC2=CC=CC=C2C(=O)OCC3=C(C(=C(C(=C3F)F)F)F)F

InChI

InChI=1S/C19H12F5NO2S2/c1-9-7-28-19(25-9)29-8-10-4-2-3-5-11(10)18(26)27-6-12-13(20)15(22)17(24)16(23)14(12)21/h2-5,7H,6,8H2,1H3