| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | [Na+][O-]S(=O)(=O)c1cc(/N=N/c2ccc(cc2)c2ccc(cc2)/N=N/c2cc(c3ccccc3c2N)S(=O)(=O)[O-][Na+])c(N)c2ccccc12 |
| InChI | InChI | 1.06 | InChI=1S/C32H24N6O6S2.2Na/c33-31-25-7-3-1-5-23(25)29(45(39,40)41)17-27(31)37-35-21-13-9-19(10-14-21)20-11-15-22(16-12-20)36-38-28-18-30(46(42,43)44)24-6-2-4-8-26(24)32(28)34;;/h1-18H,33-34H2,(H,39,40,41)(H,42,43,44);;/q;2*+1/p-2/b37-35+,38-36+;; |
| InChIKey | InChI | 1.06 | IQFVPQOLBLOTPF-HKXUKFGYSA-L |
| SMILES_CANONICAL | CACTVS | 3.385 | Nc1c(cc(c2ccccc12)[S](=O)(=O)[O-][Na+])N=Nc3ccc(cc3)c4ccc(cc4)N=Nc5cc(c6ccccc6c5N)[S](=O)(=O)[O-][Na+] |
| SMILES | CACTVS | 3.385 | Nc1c(cc(c2ccccc12)[S](=O)(=O)[O-][Na+])N=Nc3ccc(cc3)c4ccc(cc4)N=Nc5cc(c6ccccc6c5N)[S](=O)(=O)[O-][Na+] |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | c1cc2c(cc(c(c2cc1)N)/N=N/c3ccc(cc3)c4ccc(cc4)/N=N/c5c(c6c(c(c5)S(=O)(=O)[O-][Na+])cccc6)N)S(=O)(=O)[O-][Na+] |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | c1ccc2c(c1)c(cc(c2N)N=Nc3ccc(cc3)c4ccc(cc4)N=Nc5cc(c6ccccc6c5N)S(=O)(=O)[O-][Na+])S(=O)(=O)[O-][Na+] |
