(1-azanyl-1-oxidanylidene-propan-2-yl) 2-[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl]sulfanylbenzoate

Systemtic Name: (1-azanyl-1-oxidanylidene-propan-2-yl) 2-[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl]sulfanylbenzoate Openeye Name: (2-amino-1-methyl-2-oxo-ethyl) 2-[2-(4-fluoroanilino)-2-oxo-ethyl]sulfanylbenzoate CAS Name: 2-[[2-(4-fluoroanilino)-2-oxoethyl]thio]benzoic acid (1-amino-1-oxopropan-2-yl) ester IUPAC Name: (1-amino-1-oxopropan-2-yl) 2-[2-(4-fluoroanilino)-2-oxoethyl]sulfanylbenzoate Traditional Name: 2-[[2-(4-fluoroanilino)-2-keto-ethyl]thio]benzoic acid (2-amino-2-keto-1-methyl-ethyl) ester Formula: C18H17FN2O4S MolecularWeight: 376.401983

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N)OC(=O)C1=CC=CC=C1SCC(=O)NC2=CC=C(C=C2)F

Isomeric SMILES

CC(C(=O)N)OC(=O)C1=CC=CC=C1SCC(=O)NC2=CC=C(C=C2)F

InChI

InChI=1S/C18H17FN2O4S/c1-11(17(20)23)25-18(24)14-4-2-3-5-15(14)26-10-16(22)21-13-8-6-12(19)7-9-13/h2-9,11H,10H2,1H3,(H2,20,23)(H,21,22)