Chem
J-GLOBAL ID：200907035787431842   Nikkaji number：J509.503D

CR-2039

アンドラスト
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： C15H11N9O
Molecular formula furigana： C15-H11-N9-O
Molecular weight： 333.315
InChI： InChI=1S/C15H11N9O/c25-15(11-3-1-9(2-4-11)13-17-21-22-18-13)16-12-7-5-10(6-8-12)14-19-23-24-20-14/h1-8H,(H,16,25)(H,17,18,21,22)(H,19,20,23,24)
InChI key： VXEBMQZDPONDFB-UHFFFAOYSA-N
SMILES： O=C(Nc1ccc(cc1)c1nnn[nH]1)c1ccc(cc1)c1nnn[nH]1
Systematic name  (3)：
  • 4-(1H-テトラゾール-5-イル)-N-[4-(1H-テトラゾール-5-イル)フェニル]ベンズアミド
  • 4-(1H-1,2,3,4-テトラゾール-5-イル)-N-[4-(1H-1,2,3,4-テトラゾール-5-イル)フェニル]ベンズアミド
  • 4-(1H-1,2,3,4-tetrazol-5-yl)-N-[4-(1H-1,2,3,4-tetrazol-5-yl)phenyl]benzamide
Other name (4)：
  • CR-2039
  • アンドラスト
  • Andolast
  • 4-(1H-Tetrazol-5-yl)-N-[4-(1H-tetrazol-5-yl)phenyl]benzamide
CAS registry number： 132640-22-3
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