[2-[(2-fluorophenyl)carbamoylamino]-2-oxidanylidene-ethyl] (2S)-2-(butylsulfonylamino)propanoate

Systemtic Name: [2-[(2-fluorophenyl)carbamoylamino]-2-oxidanylidene-ethyl] (2S)-2-(butylsulfonylamino)propanoate Openeye Name: [2-[(2-fluorophenyl)carbamoylamino]-2-oxo-ethyl] (2S)-2-(butylsulfonylamino)propanoate CAS Name: (2S)-2-(butylsulfonylamino)propanoic acid [2-[[(2-fluoroanilino)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[(2-fluorophenyl)carbamoylamino]-2-oxoethyl] (2S)-2-(butylsulfonylamino)propanoate Traditional Name: (2S)-2-(butylsulfonylamino)propionic acid [2-[(2-fluorophenyl)carbamoylamino]-2-keto-ethyl] ester Formula: C16H22FN3O6S MolecularWeight: 403.425783

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)NC(C)C(=O)OCC(=O)NC(=O)NC1=CC=CC=C1F

Isomeric SMILES

CCCCS(=O)(=O)N[C@@H](C)C(=O)OCC(=O)NC(=O)NC1=CC=CC=C1F

InChI

InChI=1S/C16H22FN3O6S/c1-3-4-9-27(24,25)20-11(2)15(22)26-10-14(21)19-16(23)18-13-8-6-5-7-12(13)17/h5-8,11,20H,3-4,9-10H2,1-2H3,(H2,18,19,21,23)/t11-/m0/s1