ethyl 2-[4-[(5-azanyl-2-fluoranyl-phenyl)amino]-4-oxidanylidene-butyl]sulfanylethanoate

Systemtic Name: ethyl 2-[4-[(5-azanyl-2-fluoranyl-phenyl)amino]-4-oxidanylidene-butyl]sulfanylethanoate Openeye Name: ethyl 2-[4-(5-amino-2-fluoro-anilino)-4-oxo-butyl]sulfanylacetate CAS Name: 2-[[4-(5-amino-2-fluoroanilino)-4-oxobutyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-(5-amino-2-fluoroanilino)-4-oxobutyl]sulfanylacetate Traditional Name: 2-[[4-(5-amino-2-fluoro-anilino)-4-keto-butyl]thio]acetic acid ethyl ester Formula: C14H19FN2O3S MolecularWeight: 314.375663

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19FN2O3S/c1-2-20-14(19)9-21-7-3-4-13(18)17-12-8-10(16)5-6-11(12)15/h5-6,8H,2-4,7,9,16H2,1H3,(H,17,18)