N-(2-Naphthoyl)-L-Valyl-N-{(2S)-4-[(Methylsulfonyl)Amino]-1,4-Dioxo-2-Butanyl}-L-Prolinamide

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Properties Simple | Detailed

Formula C26H32N4O7S
IUPAC Name (2s)-n-[(1s)-1-formyl-3-(methanesulfonamido)-3-oxo-propyl]-1-[(2s)-3-methyl-2-(naphthalene-2-carbonylamino)butanoyl]pyrrolidine-2-carboxamide
Molecular Mass 544.620 g·mol−1
Heat of Formation -1161.3 ± 16.7 kJ·mol−1
Dipole Moment 4.53 ± 1.08 D
Volume 633.67 Å 3
Surface Area 488.8 Å 2
HOMO Energy -9.28 ± 0.55 eV
LUMO Energy -0.96 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-1-[(2s)-3-methyl-2-(naphthalen-2-ylcarbonylamino)butanoyl]-n-[(2s)-4-(methylsulfonylamino)-1,4-dioxo-butan-2-yl]pyrrolidine-2-carboxamide
  • (2s)-n-[(1s)-1-formyl-3-keto-3-methanesulfonamido-propyl]-1-[(2s)-3-methyl-2-(naphthalene-2-carbonylamino)butanoyl]pyrrolidine-2-carboxamide
  • (2s)-n-[(1s)-1-formyl-3-methanesulfonamido-3-oxo-propyl]-1-[(2s)-3-methyl-2-(naphthalene-2-carbonylamino)butanoyl]pyrrolidine-2-carboxamide
  • (2s)-n-[(1s)-1-formyl-3-methanesulfonamido-3-oxopropyl]-1-[(2s)-3-methyl-2-[(2-naphthyl-oxomethyl)amino]-1-oxobutyl]-2-pyrrolidinecarboxamide
  • (2s)-n-[(2s)-4-methanesulfonamido-1,4-dioxobutan-2-yl]-1-[(2s)-3-methyl-2-(naphthalene-2-carbonylamino)butanoyl]pyrrolidine-2-carboxamide
  • (3s)-n-methanesulfonyl-3-({1-[n-(2-naphtoyl)-l-valyl]-l-prolyl}amino)-4-oxobutanamide
  • mno
InChIKey IGFYXXJBAZZOHF-FUDKSRODSA-N
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