Chem
J-GLOBAL ID:200907048419058419   Nikkaji number:J1.975.646G

AR-A014418

AR-A014418
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: C12H12N3[N+]O3[O-]S
Molecular formula furigana: C12-H12-N4-O4-S
Molecular weight: 308.310
InChI: InChI=1S/C12H12N4O4S/c1-20-9-4-2-8(3-5-9)6-13-11(17)15-12-14-7-10(21-12)16(18)19/h2-5,7H,6H2,1H3,(H2,13,14,15,17)
InChI key: YAEMHJKFIIIULI-UHFFFAOYSA-N
SMILES: COc1ccc(CNC(=O)Nc2ncc(s2)[N+](=O)[O-])cc1
Systematic name  (4):
  • 1-(4-メトキシベンジル)-3-(5-ニトロチアゾール-2-イル)尿素
  • N-(4-メトキシベンジル)-N′-(5-ニトロチアゾール-2-イル)尿素
  • 1-[(4-メトキシフェニル)メチル]-3-(5-ニトロ-1,3-チアゾール-2-イル)尿素
  • 1-[(4-methoxyphenyl)methyl]-3-(5-nitro-1,3-thiazol-2-yl)urea
Other name (3):
  • 1-(4-Methoxybenzyl)-3-(5-nitrothiazole-2-yl)urea
  • AR-A014418
  • N-(4-Methoxybenzyl)-N′-(5-nitrothiazole-2-yl)urea
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