| PDB CCD ID: | WW3 |
| Number of entries in BioLiP: | 1 |
| Chemical formula: | C12 H18 N4 O2 S |
| InChI: | InChI=1S/C12H18N4O2S/c13-19(17,18)12-7-5-11(6-8-12)14-15-16-9-3-1-2-4-10-16/h5-8H,1-4,9-10H2,(H2,13,17,18)/b15-14+ |
| InChIKey: | CIAKXEZVKQYCME-CCEZHUSRSA-N |
| SMILES: | | Software | SMILES |
|---|
| OpenEye OEToolkits 1.7.6 | c1cc(ccc1N=NN2CCCCCC2)S(=O)(=O)N | | OpenEye OEToolkits 1.7.6 | c1cc(ccc1/N=N/N2CCCCCC2)S(=O)(=O)N | | ACDLabs 12.01 | O=S(=O)(N)c2ccc(/N=N/N1CCCCCC1)cc2 | | CACTVS 3.385 | N[S](=O)(=O)c1ccc(cc1)N=NN2CCCCCC2 |
|
| Name: | 4-[(E)-azepan-1-yldiazenyl]benzenesulfonamide |
| ZINC: | ZINC000000080373 |
umich.edu