ethyl 2-[1-[(5-azanyl-2-fluoranyl-phenyl)amino]-1-oxidanylidene-propan-2-yl]sulfanylethanoate

Systemtic Name: ethyl 2-[1-[(5-azanyl-2-fluoranyl-phenyl)amino]-1-oxidanylidene-propan-2-yl]sulfanylethanoate Openeye Name: ethyl 2-[2-(5-amino-2-fluoro-anilino)-1-methyl-2-oxo-ethyl]sulfanylacetate CAS Name: 2-[[1-(5-amino-2-fluoroanilino)-1-oxopropan-2-yl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[1-(5-amino-2-fluoroanilino)-1-oxopropan-2-yl]sulfanylacetate Traditional Name: 2-[[2-(5-amino-2-fluoro-anilino)-2-keto-1-methyl-ethyl]thio]acetic acid ethyl ester Formula: C13H17FN2O3S MolecularWeight: 300.349083

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC(C)C(=O)NC1=C(C=CC(=C1)N)F

Isomeric SMILES

CCOC(=O)CSC(C)C(=O)NC1=C(C=CC(=C1)N)F

InChI

InChI=1S/C13H17FN2O3S/c1-3-19-12(17)7-20-8(2)13(18)16-11-6-9(15)4-5-10(11)14/h4-6,8H,3,7,15H2,1-2H3,(H,16,18)