[(2S)-1-(cyclohexylamino)-1-oxidanylidene-propan-2-yl] 5-(dimethylsulfamoyl)-2-morpholin-4-yl-benzoate

Systemtic Name: [(2S)-1-(cyclohexylamino)-1-oxidanylidene-propan-2-yl] 5-(dimethylsulfamoyl)-2-morpholin-4-yl-benzoate Openeye Name: [(1S)-2-(cyclohexylamino)-1-methyl-2-oxo-ethyl] 5-(dimethylsulfamoyl)-2-morpholino-benzoate CAS Name: 5-(dimethylsulfamoyl)-2-(4-morpholinyl)benzoic acid [(2S)-1-(cyclohexylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(cyclohexylamino)-1-oxopropan-2-yl] 5-(dimethylsulfamoyl)-2-morpholin-4-ylbenzoate Traditional Name: 5-(dimethylsulfamoyl)-2-morpholino-benzoic acid [(1S)-2-(cyclohexylamino)-2-keto-1-methyl-ethyl] ester Formula: C22H33N3O6S MolecularWeight: 467.57892

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCCCC1)OC(=O)C2=C(C=CC(=C2)S(=O)(=O)N(C)C)N3CCOCC3

Isomeric SMILES

C[C@@H](C(=O)NC1CCCCC1)OC(=O)C2=C(C=CC(=C2)S(=O)(=O)N(C)C)N3CCOCC3

InChI

InChI=1S/C22H33N3O6S/c1-16(21(26)23-17-7-5-4-6-8-17)31-22(27)19-15-18(32(28,29)24(2)3)9-10-20(19)25-11-13-30-14-12-25/h9-10,15-17H,4-8,11-14H2,1-3H3,(H,23,26)/t16-/m0/s1