2-(4-fluoranylphenoxy)ethyl 2-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]sulfanylbenzoate

Systemtic Name: 2-(4-fluoranylphenoxy)ethyl 2-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]sulfanylbenzoate Openeye Name: 2-(4-fluorophenoxy)ethyl 2-[2-(isopropylamino)-2-oxo-ethyl]sulfanylbenzoate CAS Name: 2-[[2-oxo-2-(propan-2-ylamino)ethyl]thio]benzoic acid 2-(4-fluorophenoxy)ethyl ester IUPAC Name: 2-(4-fluorophenoxy)ethyl 2-[2-oxo-2-(propan-2-ylamino)ethyl]sulfanylbenzoate Traditional Name: 2-[[2-(isopropylamino)-2-keto-ethyl]thio]benzoic acid 2-(4-fluorophenoxy)ethyl ester Formula: C20H22FNO4S MolecularWeight: 391.456383

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)CSC1=CC=CC=C1C(=O)OCCOC2=CC=C(C=C2)F

Isomeric SMILES

CC(C)NC(=O)CSC1=CC=CC=C1C(=O)OCCOC2=CC=C(C=C2)F

InChI

InChI=1S/C20H22FNO4S/c1-14(2)22-19(23)13-27-18-6-4-3-5-17(18)20(24)26-12-11-25-16-9-7-15(21)8-10-16/h3-10,14H,11-13H2,1-2H3,(H,22,23)