[(2R)-1-(cyclopropylamino)-1-oxidanylidene-propan-2-yl] 2-[(2-fluorophenyl)methylsulfanyl]benzoate

Systemtic Name: [(2R)-1-(cyclopropylamino)-1-oxidanylidene-propan-2-yl] 2-[(2-fluorophenyl)methylsulfanyl]benzoate Openeye Name: [(1R)-2-(cyclopropylamino)-1-methyl-2-oxo-ethyl] 2-[(2-fluorophenyl)methylsulfanyl]benzoate CAS Name: 2-[(2-fluorophenyl)methylthio]benzoic acid [(2R)-1-(cyclopropylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(cyclopropylamino)-1-oxopropan-2-yl] 2-[(2-fluorophenyl)methylsulfanyl]benzoate Traditional Name: 2-[(2-fluorobenzyl)thio]benzoic acid [(1R)-2-(cyclopropylamino)-2-keto-1-methyl-ethyl] ester Formula: C20H20FNO3S MolecularWeight: 373.441103

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CC1)OC(=O)C2=CC=CC=C2SCC3=CC=CC=C3F

Isomeric SMILES

C[C@H](C(=O)NC1CC1)OC(=O)C2=CC=CC=C2SCC3=CC=CC=C3F

InChI

InChI=1S/C20H20FNO3S/c1-13(19(23)22-15-10-11-15)25-20(24)16-7-3-5-9-18(16)26-12-14-6-2-4-8-17(14)21/h2-9,13,15H,10-12H2,1H3,(H,22,23)/t13-/m1/s1