diazanium3-ethyl-2-[(3-ethyl-6-sulfonato-1,3-benzothiazol-2-ylidene)hydrazinylidene]-1,3-benzothiazole-6-sulfonate
diazanium;3-ethyl-2-[(3-ethyl-6-sulfonato-1,3-benzothiazol-2-ylidene)hydrazinylidene]-1,3-benzothiazole-6-sulfonate
| Molecular Formula | C18H24N6O6S4 |
|---|---|
| Molecular Weight | 548.7 g/mol |
| Topological Polar Surface Area | 215.0 A2 |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 3 |
| Exact Mass | 548.064 |
| Heavy Atoms | 34 |
| Complexity | 883.0 |
Chemical Identifiers
| CAS Number | 30931-67-0 |
|---|---|
| SMILES | CCN1C2=C(C=C(C=C2)S(=O)(=O)[O-])SC1=NN=C3N(C4=C(S3)C=C(C=C4)S(=O)(=O)[O-])CC.[NH4+].[NH4+] |
| InChIKey | OHDRQQURAXLVGJ-UHFFFAOYSA-N |
📖 Product Overview
diazanium3-ethyl-2-[(3-ethyl-6-sulfonato-1,3-benzothiazol-2-ylidene)hydrazinylidene]-1,3-benzothiazole-6-sulfonate (CAS: 30931-67-0) is a chemical compound with molecular formula C18H24N6O6S4 and molecular weight 548.7 g/mol. Its IUPAC systematic name is diazanium;3-ethyl-2-[(3-ethyl-6-sulfonato-1,3-benzothiazol-2-ylidene)hydrazinylidene]-1,3-benzothiazole-6-sulfonate.
OHDRQQURAXLVGJ-UHFFFAOYSA-N.
SMILES: CCN1C2=C(C=C(C=C2)S(=O)(=O)[O-])SC1=NN=C3N(C4=C(S3)C=C(C=C4)S(=O)(=O)[O-])CC.[NH4+].[NH4+].
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