[(1R)-2-(cyclopropylamino)-2-oxidanylidene-1-phenyl-ethyl] (2S)-2-(butylsulfonylamino)propanoate

Systemtic Name: [(1R)-2-(cyclopropylamino)-2-oxidanylidene-1-phenyl-ethyl] (2S)-2-(butylsulfonylamino)propanoate Openeye Name: [(1R)-2-(cyclopropylamino)-2-oxo-1-phenyl-ethyl] (2S)-2-(butylsulfonylamino)propanoate CAS Name: (2S)-2-(butylsulfonylamino)propanoic acid [(1R)-2-(cyclopropylamino)-2-oxo-1-phenylethyl] ester IUPAC Name: [(1R)-2-(cyclopropylamino)-2-oxo-1-phenylethyl] (2S)-2-(butylsulfonylamino)propanoate Traditional Name: (2S)-2-(butylsulfonylamino)propionic acid [(1R)-2-(cyclopropylamino)-2-keto-1-phenyl-ethyl] ester Formula: C18H26N2O5S MolecularWeight: 382.47444

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)NC(C)C(=O)OC(C1=CC=CC=C1)C(=O)NC2CC2

Isomeric SMILES

CCCCS(=O)(=O)N[C@@H](C)C(=O)O[C@H](C1=CC=CC=C1)C(=O)NC2CC2

InChI

InChI=1S/C18H26N2O5S/c1-3-4-12-26(23,24)20-13(2)18(22)25-16(14-8-6-5-7-9-14)17(21)19-15-10-11-15/h5-9,13,15-16,20H,3-4,10-12H2,1-2H3,(H,19,21)/t13-,16+/m0/s1