Chem
J-GLOBAL ID:200907027788042138   Nikkaji number:J2.511.685B

N-[(R)-1-Phenylethyl]-3,5-[(4-acetyl-1,3-phenylene)bisoxybis(6-chloro-1,3,5-triazine-4,2-diyl)bisoxy]benzamide

N-[(R)-1-フェニルエチル]-3,5-[(4-アセチル-1,3-フェニレン)ビスオキシビス(6-クロロ-1,3,5-トリアジン-4,2-ジイル)ビスオキシ]ベンズアミド
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: C29H19Cl2N7O6
Molecular formula furigana: C29-H19-CL2-N7-O6
Molecular weight: 632.410
InChI: InChI=1S/C29H19Cl2N7O6/c1-14(16-6-4-3-5-7-16)32-23(40)17-10-19-12-20(11-17)43-28-35-25(31)36-29(38-28)44-22-13-18(8-9-21(22)15(2)39)41-26-33-24(30)34-27(37-26)42-19/h3-14H,1-2H3,(H,32,40)/t14-/m1/s1
InChI key: ZQUQFTIXHHICSA-CQSZACIVSA-N
SMILES: C[C@@H](NC(=O)c1cc2cc(c1)Oc1nc(Cl)nc(n1)Oc1cc(ccc1C(=O)C)Oc1nc(Cl)nc(n1)O2)c1ccccc1
Systematic name  (3):
  • N-[(R)-1-フェニルエチル]-3,5-[(4-アセチル-1,3-フェニレン)ビスオキシビス(6-クロロ-1,3,5-トリアジン-4,2-ジイル)ビスオキシ]ベンズアミド
  • 22-アセチル-5,17-ジクロロ-N-[(1R)-1-フェニルエチル]-2,8,14,20-テトラオキサ-4,6,16,18,26,28-ヘキサアザペンタシクロ[19.3.1.13,7.19,13.115,19]オクタコサ-1(25),3(28),4,6,9(27),10,12,15(26),16,18,21,23-ドデカエン-11-カルボキサミド
  • 22-acetyl-5,17-dichloro-N-[(1R)-1-phenylethyl]-2,8,14,20-tetraoxa-4,6,16,18,26,28-hexaazapentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(25),3(28),4,6,9(27),10,12,15(26),16,18,21,23-dodecaene-11-carboxamide
Other name (1):
  • N-[(R)-1-Phenylethyl]-3,5-[(4-acetyl-1,3-phenylene)bisoxybis(6-chloro-1,3,5-triazine-4,2-diyl)bisoxy]benzamide
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