1,3-Propanedisulfonic acid, 1,1′-[[5-[(3,4,5-trimethoxyphenyl)methyl]-2,4-pyrimidinediyl]diimino]bis[3-phenyl-, tetrasodium salt

CAS Registry Number®

97259-87-5

CAS Name

1,3-Propanedisulfonic acid, 1,1′-[[5-[(3,4,5-trimethoxyphenyl)methyl]-2,4-pyrimidinediyl]diimino]bis[3-phenyl-, tetrasodium salt

Molecular Formula

C32H38N4O15S4.4Na

Cite this Page

1,3-Propanedisulfonic acid, 1,1′-[[5-[(3,4,5-trimethoxyphenyl)methyl]-2,4-pyrimidinediyl]diimino]bis[3-phenyl-, tetrasodium salt.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=97259-87-5 (retrieved 2025-01-07) (CAS RN: 97259-87-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C32H38N4O15S4.4Na/c1-49-24-15-20(16-25(50-2)30(24)51-3)14-23-19-33-32(35-29(55(46,47)48)18-27(53(40,41)42)22-12-8-5-9-13-22)36-31(23)34-28(54(43,44)45)17-26(52(37,38)39)21-10-6-4-7-11-21;;;;/h4-13,15-16,19,26-29H,14,17-18H2,1-3H3,(H,37,38,39)(H,40,41,42)(H,43,44,45)(H,46,47,48)(H2,33,34,35,36);;;;

InChIKey

InChIKey=WECDBHZMDCBSNF-UHFFFAOYSA-N

SMILES

N(C(CC(S(=O)(=O)O)C1=CC=CC=C1)S(=O)(=O)O)C=2C(CC3=CC(OC)=C(OC)C(OC)=C3)=CN=C(NC(CC(S(=O)(=O)O)C4=CC=CC=C4)S(=O)(=O)O)N2.[Na]

Canonical SMILES

[Na].O=S(=O)(O)C(NC1=NC=C(C(=N1)NC(CC(C=2C=CC=CC2)S(=O)(=O)O)S(=O)(=O)O)CC3=CC(OC)=C(OC)C(OC)=C3)CC(C=4C=CC=CC4)S(=O)(=O)O

Other Names for this Substance

  • 1,3-Propanedisulfonic acid, 1,1′-[[5-[(3,4,5-trimethoxyphenyl)methyl]-2,4-pyrimidinediyl]diimino]bis[3-phenyl-, tetrasodium salt

CAS INSIGHTSTM
A collage showcasing diverse technology, including gadgets, devices, and innovative tools in a vibrant arrangement.