[2-[[(2S)-butan-2-yl]amino]-2-oxidanylidene-ethyl] 2-(thiophen-2-ylsulfonylamino)benzoate

Systemtic Name: [2-[[(2S)-butan-2-yl]amino]-2-oxidanylidene-ethyl] 2-(thiophen-2-ylsulfonylamino)benzoate Openeye Name: [2-[[(1S)-1-methylpropyl]amino]-2-oxo-ethyl] 2-(2-thienylsulfonylamino)benzoate CAS Name: 2-(thiophen-2-ylsulfonylamino)benzoic acid [2-[[(2S)-butan-2-yl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[(2S)-butan-2-yl]amino]-2-oxoethyl] 2-(thiophen-2-ylsulfonylamino)benzoate Traditional Name: 2-(2-thienylsulfonylamino)benzoic acid [2-keto-2-[[(1S)-1-methylpropyl]amino]ethyl] ester Formula: C17H20N2O5S2 MolecularWeight: 396.4811

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)COC(=O)C1=CC=CC=C1NS(=O)(=O)C2=CC=CS2

Isomeric SMILES

CC[C@H](C)NC(=O)COC(=O)C1=CC=CC=C1NS(=O)(=O)C2=CC=CS2

InChI

InChI=1S/C17H20N2O5S2/c1-3-12(2)18-15(20)11-24-17(21)13-7-4-5-8-14(13)19-26(22,23)16-9-6-10-25-16/h4-10,12,19H,3,11H2,1-2H3,(H,18,20)/t12-/m0/s1