(2S)-2-acetamido-N-[2-(hydroxymethyl)-1,3-bis(oxidanyl)propan-2-yl]-3-phenylsulfanyl-propanamide

Systemtic Name: (2S)-2-acetamido-N-[2-(hydroxymethyl)-1,3-bis(oxidanyl)propan-2-yl]-3-phenylsulfanyl-propanamide Openeye Name: (2S)-2-acetamido-N-[2-hydroxy-1,1-bis(hydroxymethyl)ethyl]-3-phenylsulfanyl-propanamide CAS Name: (2S)-2-acetamido-N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]-3-(phenylthio)propanamide IUPAC Name: (2S)-2-acetamido-N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]-3-phenylsulfanylpropanamide Traditional Name: (2S)-2-acetamido-N-(2-hydroxy-1,1-dimethylol-ethyl)-3-(phenylthio)propionamide Formula: C15H22N2O5S MolecularWeight: 342.41058

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CSC1=CC=CC=C1)C(=O)NC(CO)(CO)CO

Isomeric SMILES

CC(=O)N[C@H](CSC1=CC=CC=C1)C(=O)NC(CO)(CO)CO

InChI

InChI=1S/C15H22N2O5S/c1-11(21)16-13(7-23-12-5-3-2-4-6-12)14(22)17-15(8-18,9-19)10-20/h2-6,13,18-20H,7-10H2,1H3,(H,16,21)(H,17,22)/t13-/m1/s1