Chem
J-GLOBAL ID：200907090724754421   Nikkaji number：J457.276I

1-(2-Carboxyethyl)-3-(p-nitrophenyl)thiourea

3-[3-(4-ニトロフェニル)チオウレイド]プロピオン酸
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C10H11N2[N+]O3[O-]S
Molecular formula furigana： C10-H11-N3-O4-S
Molecular weight： 269.280
InChI： InChI=1S/C10H11N3O4S/c14-9(15)5-6-11-10(18)12-7-1-3-8(4-2-7)13(16)17/h1-4H,5-6H2,(H,14,15)(H2,11,12,18)
InChI key： DBFYASVHFRFUPB-UHFFFAOYSA-N
SMILES： OC(=O)CCNC(=S)Nc1ccc(cc1)[N+](=O)[O-]
Systematic name  (5)：
  • 3-[3-(p-ニトロフェニル)チオウレイド]プロピオン酸
  • 1-(2-カルボキシエチル)-3-(p-ニトロフェニル)チオ尿素
  • 3-[3-(4-ニトロフェニル)チオウレイド]プロピオン酸
  • 3-{[(4-ニトロフェニル)カルバモチオイル]アミノ}プロパン酸
  • 3-{[(4-nitrophenyl)carbamothioyl]amino}propanoic acid
Other name (3)：
  • 3-[3-(p-Nitrophenyl)thioureido]propionic acid
  • 1-(2-Carboxyethyl)-3-(p-nitrophenyl)thiourea
  • 3-[3-(4-Nitrophenyl)thioureido]propionic acid
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