[2-oxidanylidene-2-[(2-propan-2-ylphenyl)amino]ethyl] 3-(thiophen-2-ylsulfonylamino)propanoate

Systemtic Name: [2-oxidanylidene-2-[(2-propan-2-ylphenyl)amino]ethyl] 3-(thiophen-2-ylsulfonylamino)propanoate Openeye Name: [2-(2-isopropylanilino)-2-oxo-ethyl] 3-(2-thienylsulfonylamino)propanoate CAS Name: 3-(thiophen-2-ylsulfonylamino)propanoic acid [2-oxo-2-(2-propan-2-ylanilino)ethyl] ester IUPAC Name: [2-oxo-2-(2-propan-2-ylanilino)ethyl] 3-(thiophen-2-ylsulfonylamino)propanoate Traditional Name: 3-(2-thienylsulfonylamino)propionic acid [2-(2-isopropylanilino)-2-keto-ethyl] ester Formula: C18H22N2O5S2 MolecularWeight: 410.50768

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1NC(=O)COC(=O)CCNS(=O)(=O)C2=CC=CS2

Isomeric SMILES

CC(C)C1=CC=CC=C1NC(=O)COC(=O)CCNS(=O)(=O)C2=CC=CS2

InChI

InChI=1S/C18H22N2O5S2/c1-13(2)14-6-3-4-7-15(14)20-16(21)12-25-17(22)9-10-19-27(23,24)18-8-5-11-26-18/h3-8,11,13,19H,9-10,12H2,1-2H3,(H,20,21)