ethyl 2-[4-[(3-azanyl-4-fluoranyl-phenyl)amino]-4-oxidanylidene-butyl]sulfanylethanoate

Systemtic Name: ethyl 2-[4-[(3-azanyl-4-fluoranyl-phenyl)amino]-4-oxidanylidene-butyl]sulfanylethanoate Openeye Name: ethyl 2-[4-(3-amino-4-fluoro-anilino)-4-oxo-butyl]sulfanylacetate CAS Name: 2-[[4-(3-amino-4-fluoroanilino)-4-oxobutyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-(3-amino-4-fluoroanilino)-4-oxobutyl]sulfanylacetate Traditional Name: 2-[[4-(3-amino-4-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=CC(=C(C=C1)F)N

Isomeric SMILES

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

InChI

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