Ethyl 4-[[5-[5-(1,3-dioxo-1H-benz[de]isoquinolin-2(3H)-yl)pentyl]-1,3,4-oxadiazol-2-yl]thio]butanoate

CAS Registry Number®

611172-97-5
No image available.

CAS Name

Ethyl 4-[[5-[5-(1,3-dioxo-1H-benz[de]isoquinolin-2(3H)-yl)pentyl]-1,3,4-oxadiazol-2-yl]thio]butanoate

Molecular Formula

C25H27N3O5S

Molecular Mass

481.56

Cite this Page

Ethyl 4-[[5-[5-(1,3-dioxo-1H-benz[de]isoquinolin-2(3H)-yl)pentyl]-1,3,4-oxadiazol-2-yl]thio]butanoate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=611172-97-5 (retrieved 2024-08-31) (CAS RN: 611172-97-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C25H27N3O5S/c1-2-32-21(29)14-8-16-34-25-27-26-20(33-25)13-4-3-5-15-28-23(30)18-11-6-9-17-10-7-12-19(22(17)18)24(28)31/h6-7,9-12H,2-5,8,13-16H2,1H3

InChIKey

InChIKey=DWFVGYNDUOXSRJ-UHFFFAOYSA-N

SMILES

O=C1C=2C=3C(C(=O)N1CCCCCC=4OC(SCCCC(OCC)=O)=NN4)=CC=CC3C=CC2

Canonical SMILES

O=C(OCC)CCCSC1=NN=C(O1)CCCCCN2C(=O)C=3C=CC=C4C=CC=C(C2=O)C43

Other Names for this Substance

  • Butanoic acid, 4-[[5-[5-(1,3-dioxo-1H-benz[de]isoquinolin-2(3H)-yl)pentyl]-1,3,4-oxadiazol-2-yl]thio]-, ethyl ester
  • Ethyl 4-[[5-[5-(1,3-dioxo-1H-benz[de]isoquinolin-2(3H)-yl)pentyl]-1,3,4-oxadiazol-2-yl]thio]butanoate