Chem
J-GLOBAL ID:201607009256171760   Nikkaji number:J3.519.658G

2′-Nitro-5′-chloro-β-(3-propylthioureido)propiophenone

2′-ニトロ-5′-クロロ-β-(3-プロピルチオウレイド)プロピオフェノン
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: C13H16ClN2[N+]O2[O-]S
Molecular formula furigana: C13-H16-CL-N3-O3-S
Molecular weight: 329.800
InChI: InChI=1S/C13H16ClN3O3S/c1-2-6-15-13(21)16-7-5-12(18)10-8-9(14)3-4-11(10)17(19)20/h3-4,8H,2,5-7H2,1H3,(H2,15,16,21)
InChI key: BQRIDMLDEVMECB-UHFFFAOYSA-N
SMILES: CCCNC(=S)NCCC(=O)c1cc(Cl)ccc1[N+](=O)[O-]
Systematic name  (3):
  • 2′-ニトロ-5′-クロロ-β-(3-プロピルチオウレイド)プロピオフェノン
  • 1-[3-(5-クロロ-2-ニトロフェニル)-3-オキソプロピル]-3-プロピルチオ尿素
  • 1-[3-(5-chloro-2-nitrophenyl)-3-oxopropyl]-3-propylthiourea
Other name (1):
  • 2′-Nitro-5′-chloro-β-(3-propylthioureido)propiophenone
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