| PDB CCD ID: | QSN |
| Number of entries in BioLiP: | 1 |
| Chemical formula: | C12 H10 N6 O6 S |
| InChI: | InChI=1S/C12H10N6O6S/c1-25(23,24)15-17-11(19)7-4-9(16-3-2-13-6-16)10(18(21)22)5-8(7)14-12(17)20/h2-6,15H,1H3,(H,14,20) |
| InChIKey: | CSIKZRHFFDICGQ-UHFFFAOYSA-N |
| SMILES: | | Software | SMILES |
|---|
| CACTVS 3.370 | C[S](=O)(=O)NN1C(=O)Nc2cc(c(cc2C1=O)n3ccnc3)[N+]([O-])=O | | OpenEye OEToolkits 1.7.0 | CS(=O)(=O)NN1C(=O)c2cc(c(cc2NC1=O)[N+](=O)[O-])n3ccnc3 | | ACDLabs 12.01 | [O-][N+](=O)c2c(n1ccnc1)cc3C(=O)N(C(=O)Nc3c2)NS(=O)(=O)C |
|
| Name: | N-[6-(1H-imidazol-1-yl)-7-nitro-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl]methanesulfonamide |
| ChEMBL: | CHEMBL1738879 |
| ZINC: | ZINC000035996436 |
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