Chemical Compound

2-[1-cyano-2-(3-hydroxy-3-methylbutoxy)-2-oxoethylidene]-7-[(1r,1's,4r,4'r)-4'-ethyl-[1,1'-bi(cyclohexane)]-4-carbonyloxy]-2H-1,3-benzodithiol-4-yl (1r,1's,4r,4'r)-4'-ethyl-[1,1'-bi(cyclohexane)]-4-carboxylate

2-[1-cyano-2-(3-hydroxy-3-methylbutoxy)-2-oxoethylidene]-7-[(1r,1's,4r,4'r)-4'-ethyl-[1,1'-bi(cyclohexane)]-4-carbonyloxy]-2H-1,3-benzodithiol-4-yl (1r,1's,4r,4'r)-4'-ethyl-[1,1'-bi(cyclohexane)]-4-carboxylate 结构式
Primary record

2-[1-cyano-2-(3-hydroxy-3-methylbutoxy)-2-oxoethylidene]-7-[(1r,1's,4r,4'r)-4'-ethyl-[1,1'-bi(cyclohexane)]-4-carbonyloxy]-2H-1,3-benzodithiol-4-yl (1r,1's,4r,4'r)-4'-ethyl-[1,1'-bi(cyclohexane)]-4-carboxylate

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
87414910
SMILES
CCC1CCC(CC1)C2CCC(CC2)C(=O)OC3=C4C(=C(C=C3)OC(=O)C5CCC(CC5)C6CCC(CC6)CC)SC(=C(C#N)C(=O)OCCC(C)(C)O)S4
Canonical SMILES
CCC1CCC(C2CCC(C(=O)Oc3ccc(OC(=O)C4CCC(C5CCC(CC)CC5)CC4)c4c3SC(=C(C#N)C(=O)OCCC(C)(C)O)S4)CC2)CC1

名称与同义词

  • SCHEMBL2631267
  • SCHEMBL17549428
  • J2.536.761H
  • 2-[1-cyano-2-(3-hydroxy-3-methylbutoxy)-2-oxoethylidene]-7-[(1r,1's,4r,4'r)-4'-ethyl-[1,1'-bi(cyclohexane)]-4-carbonyloxy]-2H-1,3-benzodithiol-4-yl (1r,1's,4r,4'r)-4'-ethyl-[1,1'-bi(cyclohexane)]-4-carboxylate
  • 2-[4,7-Bis[[(1alpha)-4beta-[(1alpha)-4beta-ethylcyclohexyl]cyclohexyl]carbonyloxy]-1,3-benzodithiol-2-ylidene]-2-cyanoacetic acid 3-hydroxy-3-methylbutyl ester