Chem
J-GLOBAL ID：200907034357407267   Nikkaji number：J756.681F

2-[4-(4-Nitrobenzyloxy)phenethyl]isothiourea

2-[4-(4-ニトロベンジルオキシ)フェネチル]イソチオ尿素
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： C16H17N2[N+]O2[O-]S
Molecular formula furigana： C16-H17-N3-O3-S
Molecular weight： 331.390
InChI： InChI=1S/C16H17N3O3S/c17-16(18)23-10-9-12-3-7-15(8-4-12)22-11-13-1-5-14(6-2-13)19(20)21/h1-8H,9-11H2,(H3,17,18)
InChI key： UMJUNUMSJDTYTM-UHFFFAOYSA-N
SMILES： NC(=N)SCCc1ccc(OCc2ccc(cc2)[N+](=O)[O-])cc1
Systematic name  (6)：
  • 2-[4-[(4-ニトロベンジル)オキシ]フェネチル]イソチオ尿素
  • 2-[2-[4-(4-ニトロベンジルオキシ)フェニル]エチル]イソチオ尿素
  • 2-[4-(4-ニトロベンジルオキシ)フェネチル]イソチオ尿素
  • 2-[2-[4-[(4-ニトロベンジル)オキシ]フェニル]エチル]イソチオ尿素
  • [(2-{4-[(4-ニトロフェニル)メトキシ]フェニル}エチル)スルファニル]メタンイミドアミド
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Other name (3)：
  • 2-[4-(4-Nitrobenzyloxy)phenethyl]isothiourea
  • 2-[2-[4-(4-Nitrobenzyloxy)phenyl]ethyl]isothiourea
  • 2-[2-[4-[(4-Nitrobenzyl)oxy]phenyl]ethyl]isothiourea
Thsaurus map：
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