ethyl 2-[3-[(5-azanyl-2-fluoranyl-phenyl)amino]-3-oxidanylidene-propyl]sulfanylethanoate

Systemtic Name: ethyl 2-[3-[(5-azanyl-2-fluoranyl-phenyl)amino]-3-oxidanylidene-propyl]sulfanylethanoate Openeye Name: ethyl 2-[3-(5-amino-2-fluoro-anilino)-3-oxo-propyl]sulfanylacetate CAS Name: 2-[[3-(5-amino-2-fluoroanilino)-3-oxopropyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[3-(5-amino-2-fluoroanilino)-3-oxopropyl]sulfanylacetate Traditional Name: 2-[[3-(5-amino-2-fluoro-anilino)-3-keto-propyl]thio]acetic acid ethyl ester Formula: C13H17FN2O3S MolecularWeight: 300.349083

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17FN2O3S/c1-2-19-13(18)8-20-6-5-12(17)16-11-7-9(15)3-4-10(11)14/h3-4,7H,2,5-6,8,15H2,1H3,(H,16,17)