2-Methyl-2-Propanyl [(2S)-3-Methyl-1-{(2R,3S)-3-[(Methylsulfonyl)Amino]-2-[(2S)-1-Oxo-2-Butanyl]-1-Pyrrolidinyl}-1-Oxo-2-Butanyl]Carbamate

Molecule SVG Image

Properties Simple | Detailed

Formula C19H35N3O6S
IUPAC Name tert-butyl n-[(1s)-1-[(2r,3s)-2-[(1s)-1-formylpropyl]-3-(methanesulfonamido)pyrrolidine-1-carbonyl]-2-methyl-propyl]carbamate
Molecular Mass 433.563 g·mol−1
Heat of Formation -1287.4 ± 16.7 kJ·mol−1
Dipole Moment 3.95 ± 1.08 D
Volume 539.59 Å 3
Surface Area 419.78 Å 2
HOMO Energy -9.58 ± 0.55 eV
LUMO Energy 0.58 ± eV
Point Group Symmetry C1
Synonyms
  • gw472467x
  • n-[(1s)-1-[(2r,3s)-2-[(1s)-1-formylpropyl]-3-methanesulfonamido-pyrrolidine-1-carbonyl]-2-methyl-propyl]carbamic acid tert-butyl ester
  • n-[(1s)-1-[[(2r,3s)-2-[(1s)-1-formylpropyl]-3-methanesulfonamido-1-pyrrolidinyl]-oxomethyl]-2-methylpropyl]carbamic acid tert-butyl ester
  • tert-butyl n-[(1s)-1-[(2r,3s)-2-[(1s)-1-formylpropyl]-3-methanesulfonamido-pyrrolidine-1-carbonyl]-2-methyl-propyl]carbamate
  • tert-butyl n-[(2s)-1-[(2r,3s)-3-methanesulfonamido-2-[(2s)-1-oxobutan-2-yl]pyrrolidin-1-yl]-3-methyl-1-oxobutan-2-yl]carbamate
  • tert-butyl n-[(2s)-3-methyl-1-[(2r,3s)-3-(methylsulfonylamino)-2-[(2s)-1-oxobutan-2-yl]pyrrolidin-1-yl]-1-oxo-butan-2-yl]carbamate
  • trl
  • {1-[2-(1-formyl-propyl)-3-methanesulfonylamino-pyrrolidine-1-carbonyl]-2-methyl-propyl}-carbamic acid tert-butyl ester
InChIKey NOWIRVOXJOWTSQ-FXUDXRNXSA-N
QR Code Generate QR Code
Links PubChem ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C S O N