(2E,4E,6E)-N-[(1S)-3-({(2S)-3-Methyl-1-[(3R,4S)-4-Methyl-2,5-Dioxo-3-Pyrrolidinyl]-1-Oxo-2-Butanyl}Amino)-3-Oxo-1-Phenylpropyl]-2,4,6-Octatrienamide

Molecule SVG Image

Properties Simple | Detailed

Formula C27H33N3O5
IUPAC Name (2e,4e,6e)-n-[(1s)-3-[[(1s)-2-methyl-1-[(3r,4s)-4-methyl-2,5-dioxo-pyrrolidine-3-carbonyl]propyl]amino]-3-oxo-1-phenyl-propyl]octa-2,4,6-trienamide
Molecular Mass 479.568 g·mol−1
Heat of Formation -742.9 ± 16.7 kJ·mol−1
Dipole Moment 1.40 ± 1.08 D
Volume 614.11 Å 3
Surface Area 500.44 Å 2
HOMO Energy -8.90 ± 0.55 eV
LUMO Energy -0.64 ± eV
Point Group Symmetry C1
Synonyms
  • (2e,4e,6e)-n-[(1s)-3-[[(1s)-1-[(3r,4s)-2,5-diketo-4-methyl-pyrrolidine-3-carbonyl]-2-methyl-propyl]amino]-3-keto-1-phenyl-propyl]octa-2,4,6-trienamide
  • (2e,4e,6e)-n-[(1s)-3-[[(1s)-2-methyl-1-[(3r,4s)-4-methyl-2,5-dioxo-pyrrolidine-3-carbonyl]propyl]amino]-3-oxo-1-phenyl-propyl]octa-2,4,6-trienamide
  • (2e,4e,6e)-n-[(1s)-3-[[(1s)-2-methyl-1-[[(3r,4s)-4-methyl-2,5-dioxo-3-pyrrolidinyl]-oxomethyl]propyl]amino]-3-oxo-1-phenylpropyl]octa-2,4,6-trienamide
  • (2e,4e,6e)-n-[(1s)-3-[[(2s)-3-methyl-1-[(3r,4s)-4-methyl-2,5-dioxo-pyrrolidin-3-yl]-1-oxo-butan-2-yl]amino]-3-oxo-1-phenyl-propyl]octa-2,4,6-trienamide
  • (2e,4e,6e)-n-[(1s)-3-[[(2s)-3-methyl-1-[(3r,4s)-4-methyl-2,5-dioxopyrrolidin-3-yl]-1-oxobutan-2-yl]amino]-3-oxo-1-phenylpropyl]octa-2,4,6-trienamide
  • andrimid
  • benzenepropanamide, n-[(1s)-2-methyl-1-[[(3r,4s)-4-methyl-2,5-dioxo-3-pyrrolidinyl]carbonyl]propyl]-beta-[[(2e,4e,6e)-1-oxo-2,4,6-octatrienyl]amino]-, (betas)-
  • octa-2,4,6-trienoic acid [2-[2-methyl-1-(4-methyl-2,5-dioxo-pyrrolidine-3-carbonyl)-propylcarbamoyl]-1-phenyl-ethyl]-amide
  • rel-(2e,4e,6e)-n-{(1r)-3-[((1r)-2-methyl-1-{[(3s,4r)-4-methyl-2,5-dioxopyrrolidin-3-yl]carbonyl}propyl)amino]-3-oxo-1-phenylpropyl}octa-2,4,6-trienamide
CAS Number(s)
  • 108868-95-7
InChIKey OHDXGZAYYBMHCY-QSUIEZAASA-N
QR Code Generate QR Code
Links PubChem ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N