[(2R)-1-[[(3R)-1,1-bis(oxidanylidene)thiolan-3-yl]amino]-1-oxidanylidene-propan-2-yl] (2S)-2-benzamidopropanoate

Systemtic Name: [(2R)-1-[[(3R)-1,1-bis(oxidanylidene)thiolan-3-yl]amino]-1-oxidanylidene-propan-2-yl] (2S)-2-benzamidopropanoate Openeye Name: [(1R)-2-[[(3R)-1,1-dioxothiolan-3-yl]amino]-1-methyl-2-oxo-ethyl] (2S)-2-benzamidopropanoate CAS Name: (2S)-2-benzamidopropanoic acid [(2R)-1-[[(3R)-1,1-dioxo-3-thiolanyl]amino]-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-[[(3R)-1,1-dioxothiolan-3-yl]amino]-1-oxopropan-2-yl] (2S)-2-benzamidopropanoate Traditional Name: (2S)-2-benzamidopropionic acid [(1R)-2-[[(3R)-1,1-diketothiolan-3-yl]amino]-2-keto-1-methyl-ethyl] ester Formula: C17H22N2O6S MolecularWeight: 382.43138

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC(C)C(=O)NC1CCS(=O)(=O)C1)NC(=O)C2=CC=CC=C2

Isomeric SMILES

C[C@@H](C(=O)O[C@H](C)C(=O)N[C@@H]1CCS(=O)(=O)C1)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C17H22N2O6S/c1-11(18-16(21)13-6-4-3-5-7-13)17(22)25-12(2)15(20)19-14-8-9-26(23,24)10-14/h3-7,11-12,14H,8-10H2,1-2H3,(H,18,21)(H,19,20)/t11-,12+,14+/m0/s1