| PDB CCD ID: | X43 |
| Number of entries in BioLiP: | 1 |
| Chemical formula: | C16 H13 N5 O5 S2 |
| InChI: | InChI=1S/C16H13N5O5S2/c17-15-14(13(22)9-2-1-3-11(8-9)21(23)24)27-16(20-15)19-10-4-6-12(7-5-10)28(18,25)26/h1-8H,17H2,(H,19,20)(H2,18,25,26) |
| InChIKey: | UNSUKTMPEHFJHC-UHFFFAOYSA-N |
| SMILES: | | Software | SMILES |
|---|
| ACDLabs 12.01 | [O-][N+](=O)c1cccc(c1)C(=O)c2sc(nc2N)Nc3ccc(cc3)S(=O)(=O)N | | OpenEye OEToolkits 1.7.0 | c1cc(cc(c1)[N+](=O)[O-])C(=O)c2c(nc(s2)Nc3ccc(cc3)S(=O)(=O)N)N | | CACTVS 3.370 | Nc1nc(Nc2ccc(cc2)[S](N)(=O)=O)sc1C(=O)c3cccc(c3)[N+]([O-])=O |
|
| Name: | 4-{[4-amino-5-(3-nitrobenzoyl)-1,3-thiazol-2-yl]amino}benzenesulfonamide |
| ChEMBL: | CHEMBL2377822 |
| ZINC: | ZINC000095920696 |
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