SODIUM 5-CHLORO-2-[(1E)-3-[(2E)-5-CHLORO-3-(4-SULFONATOBUTYL)-2,3-DIHYDRO-1,3-BENZOTHIAZOL-2-YLIDENE]-2-METHYLPROP-1-EN-1-YL]-3-(4-SULFONATOBUTYL)-1,3-BENZOTHIAZOL-3-IUM | CAS 18426-61-4

Catalog Id:
MM18426614

IUPAC:
SODIUM4-[5-CHLORO-2-[(E,3E)-3-[5-CHLORO-3-(4-SULFONATOBUTYL)-1,3-BENZOTHIAZOL-2-YLIDENE]-2-METHYL-PROP-1-ENYL]-1,3-BENZOTHIAZOL-3-IUM-3-YL]BUTANE-1-SULFONATE

CAS Number:
18426-61-4

Molecular Weight:
685.64

Formula:
C26H27Cl2N2NaO6S4

SMILES:
[Na+].C\C(=C/C1=[N+](CCCCS([O-])(=O)=O)C2=CC(Cl)=CC=C2S1)\C=C1\SC2=CC=C(Cl)C=C2N1CCCCS([O-])(=O)=O

Preferred IUPAC Name:
SODIUM 5-CHLORO-2-[(1E)-3-[(2E)-5-CHLORO-3-(4-SULFONATOBUTYL)-2,3-DIHYDRO-1,3-BENZOTHIAZOL-2-YLIDENE]-2-METHYLPROP-1-EN-1-YL]-3-(4-SULFONATOBUTYL)-1,3-BENZOTHIAZOL-3-IUM

InChIKey:
InChIKey=KDMFYPGMNYJKCG-UHFFFAOYSA-M

Categories:
Aliphatic Cyclic Structures, Aliphatic Heterocycles, Aromatic Heterocycles, Heterocyclic Compounds, Aromatic Cyclic Structures, Aryl Halides