[(2S)-1-(ethylamino)-1-oxidanylidene-propan-2-yl] 3-[(2,5-dimethylphenyl)sulfonylamino]benzoate

Systemtic Name: [(2S)-1-(ethylamino)-1-oxidanylidene-propan-2-yl] 3-[(2,5-dimethylphenyl)sulfonylamino]benzoate Openeye Name: [(1S)-2-(ethylamino)-1-methyl-2-oxo-ethyl] 3-[(2,5-dimethylphenyl)sulfonylamino]benzoate CAS Name: 3-[(2,5-dimethylphenyl)sulfonylamino]benzoic acid [(2S)-1-(ethylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(ethylamino)-1-oxopropan-2-yl] 3-[(2,5-dimethylphenyl)sulfonylamino]benzoate Traditional Name: 3-[(2,5-dimethylphenyl)sulfonylamino]benzoic acid [(1S)-2-(ethylamino)-2-keto-1-methyl-ethyl] ester Formula: C20H24N2O5S MolecularWeight: 404.47996

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C(C)OC(=O)C1=CC(=CC=C1)NS(=O)(=O)C2=C(C=CC(=C2)C)C

Isomeric SMILES

CCNC(=O)[C@H](C)OC(=O)C1=CC(=CC=C1)NS(=O)(=O)C2=C(C=CC(=C2)C)C

InChI

InChI=1S/C20H24N2O5S/c1-5-21-19(23)15(4)27-20(24)16-7-6-8-17(12-16)22-28(25,26)18-11-13(2)9-10-14(18)3/h6-12,15,22H,5H2,1-4H3,(H,21,23)/t15-/m0/s1