Chem
J-GLOBAL ID：200907050917318830   Nikkaji number：J2.504.428B

AR-A-014418

AR-A-014418
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)15-12-14-10(7-21-12)16(18)19/h2-5,7H,6H2,1H3,(H2,13,14,15,17)
InChI key： VZEKMDQQVYEVAH-UHFFFAOYSA-N
SMILES： COc1ccc(CNC(=O)Nc2nc(cs2)[N+](=O)[O-])cc1
Systematic name  (3)：
  • 1-(4-ニトロチアゾール-2-イル)-3-(4-メトキシベンジル)尿素
  • 1-[(4-メトキシフェニル)メチル]-3-(4-ニトロ-1,3-チアゾール-2-イル)尿素
  • 1-[(4-methoxyphenyl)methyl]-3-(4-nitro-1,3-thiazol-2-yl)urea
Other name (2)：
  • 1-(4-Nitrothiazole-2-yl)-3-(4-methoxybenzyl)urea
  • AR-A-014418
Thsaurus map：
Thesaurus Map

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