(2-azanyl-2-oxidanylidene-ethyl) 2-[2-[(2-fluorophenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoate

Systemtic Name: (2-azanyl-2-oxidanylidene-ethyl) 2-[2-[(2-fluorophenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoate Openeye Name: (2-amino-2-oxo-ethyl) 2-[2-(2-fluoroanilino)-2-oxo-ethyl]sulfanylacetate CAS Name: 2-[[2-(2-fluoroanilino)-2-oxoethyl]thio]acetic acid (2-amino-2-oxoethyl) ester IUPAC Name: (2-amino-2-oxoethyl) 2-[2-(2-fluoroanilino)-2-oxoethyl]sulfanylacetate Traditional Name: 2-[[2-(2-fluoroanilino)-2-keto-ethyl]thio]acetic acid (2-amino-2-keto-ethyl) ester Formula: C12H13FN2O4S MolecularWeight: 300.306023

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC(=O)CSCC(=O)OCC(=O)N)F

Isomeric SMILES

C1=CC=C(C(=C1)NC(=O)CSCC(=O)OCC(=O)N)F

InChI

InChI=1S/C12H13FN2O4S/c13-8-3-1-2-4-9(8)15-11(17)6-20-7-12(18)19-5-10(14)16/h1-4H,5-7H2,(H2,14,16)(H,15,17)