[2-oxidanylidene-2-[[2-(propan-2-ylcarbamoyl)phenyl]amino]ethyl] 4-methylsulfinylbenzoate

Systemtic Name: [2-oxidanylidene-2-[[2-(propan-2-ylcarbamoyl)phenyl]amino]ethyl] 4-methylsulfinylbenzoate Openeye Name: [2-[2-(isopropylcarbamoyl)anilino]-2-oxo-ethyl] 4-methylsulfinylbenzoate CAS Name: 4-methylsulfinylbenzoic acid [2-oxo-2-[2-[oxo-(propan-2-ylamino)methyl]anilino]ethyl] ester IUPAC Name: [2-oxo-2-[2-(propan-2-ylcarbamoyl)anilino]ethyl] 4-methylsulfinylbenzoate Traditional Name: 4-methylsulfinylbenzoic acid [2-[2-(isopropylcarbamoyl)anilino]-2-keto-ethyl] ester Formula: C20H22N2O5S MolecularWeight: 402.46408

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C1=CC=CC=C1NC(=O)COC(=O)C2=CC=C(C=C2)S(=O)C

Isomeric SMILES

CC(C)NC(=O)C1=CC=CC=C1NC(=O)COC(=O)C2=CC=C(C=C2)S(=O)C

InChI

InChI=1S/C20H22N2O5S/c1-13(2)21-19(24)16-6-4-5-7-17(16)22-18(23)12-27-20(25)14-8-10-15(11-9-14)28(3)26/h4-11,13H,12H2,1-3H3,(H,21,24)(H,22,23)