Chem
J-GLOBAL ID:201607001704538318   Nikkaji number:J3.524.661D

3-(Benzyloxycarbonylamino)-2-[6-(trifluoromethyl)-2-pyridyl]-3,6-dihydropyridazine-1(2H)-carboxylic acid benzyl ester

3-(ベンジルオキシカルボニルアミノ)-2-[6-(トリフルオロメチル)-2-ピリジル]-3,6-ジヒドロピリダジン-1(2H)-カルボン酸ベンジル
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: C26H23F3N4O4
Molecular formula furigana: C26-H23-F3-N4-O4
Molecular weight: 512.489
InChI: InChI=1S/C26H23F3N4O4/c27-26(28,29)21-13-7-14-22(30-21)33-23(31-24(34)36-17-19-9-3-1-4-10-19)15-8-16-32(33)25(35)37-18-20-11-5-2-6-12-20/h1-15,23H,16-18H2,(H,31,34)
InChI key: BCCDQZPFXHLMOV-UHFFFAOYSA-N
SMILES: FC(F)(F)c1cccc(n1)N1C(NC(=O)OCc2ccccc2)C=CCN1C(=O)OCc1ccccc1
Systematic name  (4):
  • 3-(ベンジルオキシカルボニルアミノ)-2-[6-(トリフルオロメチル)-2-ピリジル]-3,6-ジヒドロピリダジン-1(2H)-カルボン酸ベンジル
  • [1-(ベンジルオキシカルボニル)-2-[6-(トリフルオロメチル)-2-ピリジル]-1,2,3,6-テトラヒドロピリダジン-3-イル]カルバミド酸ベンジル
  • ベンジル 3-{[(ベンジルオキシ)カルボニル]アミノ}-2-[6-(トリフルオロメチル)ピリジン-2-イル]-1,2,3,6-テトラヒドロピリダジン-1-カルボキシラート
  • benzyl 3-{[(benzyloxy)carbonyl]amino}-2-[6-(trifluoromethyl)pyridin-2-yl]-1,2,3,6-tetrahydropyridazine-1-carboxylate
Other name (2):
  • 3-(Benzyloxycarbonylamino)-2-[6-(trifluoromethyl)-2-pyridyl]-3,6-dihydropyridazine-1(2H)-carboxylic acid benzyl ester
  • [1-(Benzyloxycarbonyl)-2-[6-(trifluoromethyl)-2-pyridyl]-1,2,3,6-tetrahydropyridazine-3-yl]carbamic acid benzyl ester
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