[(2R)-1-(cyclopropylamino)-1-oxidanylidene-propan-2-yl] 4-[(3-fluoranyl-2-methyl-phenyl)sulfonylamino]benzoate

Systemtic Name: [(2R)-1-(cyclopropylamino)-1-oxidanylidene-propan-2-yl] 4-[(3-fluoranyl-2-methyl-phenyl)sulfonylamino]benzoate Openeye Name: [(1R)-2-(cyclopropylamino)-1-methyl-2-oxo-ethyl] 4-[(3-fluoro-2-methyl-phenyl)sulfonylamino]benzoate CAS Name: 4-[(3-fluoro-2-methylphenyl)sulfonylamino]benzoic acid [(2R)-1-(cyclopropylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(cyclopropylamino)-1-oxopropan-2-yl] 4-[(3-fluoro-2-methylphenyl)sulfonylamino]benzoate Traditional Name: 4-[(3-fluoro-2-methyl-phenyl)sulfonylamino]benzoic acid [(1R)-2-(cyclopropylamino)-2-keto-1-methyl-ethyl] ester Formula: C20H21FN2O5S MolecularWeight: 420.454543

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1S(=O)(=O)NC2=CC=C(C=C2)C(=O)OC(C)C(=O)NC3CC3)F

Isomeric SMILES

CC1=C(C=CC=C1S(=O)(=O)NC2=CC=C(C=C2)C(=O)O[C@H](C)C(=O)NC3CC3)F

InChI

InChI=1S/C20H21FN2O5S/c1-12-17(21)4-3-5-18(12)29(26,27)23-16-8-6-14(7-9-16)20(25)28-13(2)19(24)22-15-10-11-15/h3-9,13,15,23H,10-11H2,1-2H3,(H,22,24)/t13-/m1/s1