Chem
J-GLOBAL ID:200907018217090616   Nikkaji number:J2.626.776E

1-[[5-Phenyl-7-(dibenzothiophene-2-yl)-2,3-dihydro-5H-thiazolo[3,2-a]pyrimidine-6-yl]acetyl]-5-methyl-1H-1,2,3-triazole-4-carboxylic acid ethyl ester

1-[[5-フェニル-7-(ジベンゾチオフェン-2-イル)-2,3-ジヒドロ-5H-チアゾロ[3,2-a]ピリミジン-6-イル]アセチル]-5-メチル-1H-1,2,3-トリアゾール-4-カルボン酸エチル
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: C32H27N5O3S2
Molecular formula furigana: C32-H27-N5-O3-S2
Molecular weight: 593.720
InChI: InChI=1S/C32H27N5O3S2/c1-3-40-31(39)28-19(2)37(35-34-28)27(38)18-24-29(21-13-14-26-23(17-21)22-11-7-8-12-25(22)42-26)33-32-36(15-16-41-32)30(24)20-9-5-4-6-10-20/h4-14,17,30H,3,15-16,18H2,1-2H3
InChI key: AWYRHBCDPDITQK-UHFFFAOYSA-N
SMILES: CCOC(=O)c1nnn(C(=O)CC2=C(N=C3SCCN3C2c2ccccc2)c2ccc3sc4ccccc4c3c2)c1C
Systematic name  (3):
  • 1-[[5-フェニル-7-(ジベンゾチオフェン-2-イル)-2,3-ジヒドロ-5H-チアゾロ[3,2-a]ピリミジン-6-イル]アセチル]-5-メチル-1H-1,2,3-トリアゾール-4-カルボン酸エチル
  • エチル 5-メチル-1-[2-(5-フェニル-7-{8-チアトリシクロ[7.4.0.02,7]トリデカ-1(9),2(7),3,5,10,12-ヘキサエン-4-イル}-2H,3H,5H-[1,3]チアゾロ[3,2-a]ピリミジン-6-イル)アセチル]-1H-1,2,3-トリアゾール-4-カルボキシラート
  • ethyl 5-methyl-1-[2-(5-phenyl-7-{8-thiatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-4-yl}-2H,3H,5H-[1,3]thiazolo[3,2-a]pyrimidin-6-yl)acetyl]-1H-1,2,3-triazole-4-carboxylate
Other name (1):
  • 1-[[5-Phenyl-7-(dibenzothiophene-2-yl)-2,3-dihydro-5H-thiazolo[3,2-a]pyrimidine-6-yl]acetyl]-5-methyl-1H-1,2,3-triazole-4-carboxylic acid ethyl ester
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