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

Systemtic Name: [(2S)-1-(ethylcarbamoylamino)-1-oxidanylidene-propan-2-yl] 2-[(2,5-dimethylphenyl)sulfonylamino]benzoate Openeye Name: [(1S)-2-(ethylcarbamoylamino)-1-methyl-2-oxo-ethyl] 2-[(2,5-dimethylphenyl)sulfonylamino]benzoate CAS Name: 2-[(2,5-dimethylphenyl)sulfonylamino]benzoic acid [(2S)-1-(ethylcarbamoylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(ethylcarbamoylamino)-1-oxopropan-2-yl] 2-[(2,5-dimethylphenyl)sulfonylamino]benzoate Traditional Name: 2-[(2,5-dimethylphenyl)sulfonylamino]benzoic acid [(1S)-2-(ethylcarbamoylamino)-2-keto-1-methyl-ethyl] ester Formula: C21H25N3O6S MolecularWeight: 447.5047

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NC(=O)C(C)OC(=O)C1=CC=CC=C1NS(=O)(=O)C2=C(C=CC(=C2)C)C

Isomeric SMILES

CCNC(=O)NC(=O)[C@H](C)OC(=O)C1=CC=CC=C1NS(=O)(=O)C2=C(C=CC(=C2)C)C

InChI

InChI=1S/C21H25N3O6S/c1-5-22-21(27)23-19(25)15(4)30-20(26)16-8-6-7-9-17(16)24-31(28,29)18-12-13(2)10-11-14(18)3/h6-12,15,24H,5H2,1-4H3,(H2,22,23,25,27)/t15-/m0/s1