5-Benzothiazolesulfonic acid, 2-[[4-[ethyl(phenylmethyl)amino]-2-methylphenyl]azo]-, sodium salt

85098-61-9

CAS Name

5-Benzothiazolesulfonic acid, 2-[2-[4-[ethyl(phenylmethyl)amino]-2-methylphenyl]diazenyl]-, sodium salt (1:1)

Molecular Formula

C₂₃H₂₂N₄O₃S₂.Na

Other Names and Identifiers

InChI

InChI=1S/C23H22N4O3S2.Na/c1-3-27(15-17-7-5-4-6-8-17)18-9-11-20(16(2)13-18)25-26-23-24-21-14-19(32(28,29)30)10-12-22(21)31-23;/h4-14H,3,15H2,1-2H3,(H,28,29,30);

InChIKey

InChIKey=UFGJIKRMLSFVKD-UHFFFAOYSA-N

SMILES

N(=NC1=C(C)C=C(N(CC2=CC=CC=C2)CC)C=C1)C3=NC=4C(S3)=CC=C(S(=O)(=O)O)C4.[Na]

Canonical SMILES

[Na].O=S(=O)(O)C=1C=CC=2SC(N=NC3=CC=C(C=C3C)N(CC=4C=CC=CC4)CC)=NC2C1

Other Names for this Substance