[2-(3-fluorophenyl)-2-oxidanylidene-ethyl] (2S)-4-methyl-2-[(4-methylphenyl)sulfonylamino]pentanoate

Systemtic Name: [2-(3-fluorophenyl)-2-oxidanylidene-ethyl] (2S)-4-methyl-2-[(4-methylphenyl)sulfonylamino]pentanoate Openeye Name: [2-(3-fluorophenyl)-2-oxo-ethyl] (2S)-4-methyl-2-(p-tolylsulfonylamino)pentanoate CAS Name: (2S)-4-methyl-2-[(4-methylphenyl)sulfonylamino]pentanoic acid [2-(3-fluorophenyl)-2-oxoethyl] ester IUPAC Name: [2-(3-fluorophenyl)-2-oxoethyl] (2S)-4-methyl-2-[(4-methylphenyl)sulfonylamino]pentanoate Traditional Name: (2S)-4-methyl-2-(tosylamino)valeric acid [2-(3-fluorophenyl)-2-keto-ethyl] ester Formula: C21H24FNO5S MolecularWeight: 421.482363

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CC(C)C)C(=O)OCC(=O)C2=CC(=CC=C2)F

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N[C@@H](CC(C)C)C(=O)OCC(=O)C2=CC(=CC=C2)F

InChI

InChI=1S/C21H24FNO5S/c1-14(2)11-19(23-29(26,27)18-9-7-15(3)8-10-18)21(25)28-13-20(24)16-5-4-6-17(22)12-16/h4-10,12,14,19,23H,11,13H2,1-3H3/t19-/m0/s1