Chem
J-GLOBAL ID:200907001038737640   Nikkaji number:J2.185.278C

1-Benzyl-4-[bis[(4S)-4β-isopropyl-2-oxazoline-2-yl]aminomethyl]-1H-1,2,3-triazole

1-ベンジル-4-[ビス[(4S)-4β-イソプロピル-2-オキサゾリン-2-イル]アミノメチル]-1H-1,2,3-トリアゾール
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: C22H30N6O2
Molecular formula furigana: C22-H30-N6-O2
Molecular weight: 410.522
InChI: InChI=1S/C22H30N6O2/c1-15(2)19-13-29-21(23-19)28(22-24-20(14-30-22)16(3)4)12-18-11-27(26-25-18)10-17-8-6-5-7-9-17/h5-9,11,15-16,19-20H,10,12-14H2,1-4H3/t19-,20-/m1/s1
InChI key: GDDKBFNCGXQLEI-WOJBJXKFSA-N
SMILES: CC(C)[C@H]1COC(=N1)N(Cc1cn(Cc2ccccc2)nn1)C1=N[C@H](CO1)C(C)C
Systematic name  (4):
  • 2,2′-(1-ベンジル-1H-1,2,3-トリアゾール-4-イルメチルイミノ)ビス[(S)-4β-イソプロピル-2-オキサゾリン]
  • 1-ベンジル-4-[ビス[(4S)-4β-イソプロピル-2-オキサゾリン-2-イル]アミノメチル]-1H-1,2,3-トリアゾール
  • (4S)-N-[(1-ベンジル-1H-1,2,3-トリアゾール-4-イル)メチル]-4-(プロパン-2-イル)-N-[(4S)-4-(プロパン-2-イル)-4,5-ジヒドロ-1,3-オキサゾール-2-イル]-4,5-ジヒドロ-1,3-オキサゾール-2-アミン
  • (4S)-N-[(1-benzyl-1H-1,2,3-triazol-4-yl)methyl]-4-(propan-2-yl)-N-[(4S)-4-(propan-2-yl)-4,5-dihydro-1,3-oxazol-2-yl]-4,5-dihydro-1,3-oxazol-2-amine
Other name (2):
  • 2,2′-(1-Benzyl-1H-1,2,3-triazole-4-ylmethylimino)bis[(S)-4β-isopropyl-2-oxazoline]
  • 1-Benzyl-4-[bis[(4S)-4β-isopropyl-2-oxazoline-2-yl]aminomethyl]-1H-1,2,3-triazole
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