(5-fluoranyl-2-nitro-phenyl) 2-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]ethanoate

Systemtic Name: (5-fluoranyl-2-nitro-phenyl) 2-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]ethanoate Openeye Name: (5-fluoro-2-nitro-phenyl) 2-[(2-methylthiazol-4-yl)methylsulfanyl]acetate CAS Name: 2-[(2-methyl-4-thiazolyl)methylthio]acetic acid (5-fluoro-2-nitrophenyl) ester IUPAC Name: (5-fluoro-2-nitrophenyl) 2-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]acetate Traditional Name: 2-[(2-methylthiazol-4-yl)methylthio]acetic acid (5-fluoro-2-nitro-phenyl) ester Formula: C13H11FN2O4S2 MolecularWeight: 342.365843

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)CSCC(=O)OC2=C(C=CC(=C2)F)[N+](=O)[O-]

Isomeric SMILES

CC1=NC(=CS1)CSCC(=O)OC2=C(C=CC(=C2)F)[N+](=O)[O-]

InChI

InChI=1S/C13H11FN2O4S2/c1-8-15-10(6-22-8)5-21-7-13(17)20-12-4-9(14)2-3-11(12)16(18)19/h2-4,6H,5,7H2,1H3