S-Benzyl-N-(4-Nitrophenyl)Cysteinamide

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Properties Simple | Detailed

Formula C16H17N3O3S
IUPAC Name (2r)-2-amino-3-benzylsulfanyl-n-(4-nitrophenyl)propanamide
Molecular Mass 331.389 g·mol−1
Heat of Formation -16.6 ± 16.7 kJ·mol−1
Dipole Moment 8.64 ± 1.08 D
Volume 385.5 Å 3
Surface Area 351.39 Å 2
HOMO Energy -9.15 ± 0.55 eV
LUMO Energy 1.81 ± eV
Point Group Symmetry C1
Synonyms
  • (2r)-2-amino-3-(benzylthio)-n-(4-nitrophenyl)propionamide
  • (2r)-2-amino-n-(4-nitrophenyl)-3-(phenylmethylsulfanyl)propanamide
  • (2r)-2-amino-n-(4-nitrophenyl)-3-(phenylmethylthio)propanamide
  • (r)-2-amino-3-benzylthio-n-(4-nitrophenyl)propionamide
  • l-2-amino-3-(benzylthio)-4'-nitropropionanilide
  • propanamide, 2-amino-n-(4-nitrophenyl)-3-((phenylmethyl)thio)-, (2r)-
  • s-benzyl-l-cysteine p-nitroanilide
  • s-benzyl-l-cysteine-4'-nitroanilide
CAS Number(s)
  • 7436-62-6
InChIKey HOZQMLJHNCMSRC-HNNXBMFYSA-N
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