| PDB CCD ID: | E1G |
| Number of entries in BioLiP: | 3 |
| Chemical formula: | C12 H11 N3 O3 S2 |
| InChI: | InChI=1S/C12H11N3O3S2/c13-20(17,18)10-4-1-3-9(7-10)11(16)8-19-12-14-5-2-6-15-12/h1-7H,8H2,(H2,13,17,18) |
| InChIKey: | BWAZRCOFUQSGBG-UHFFFAOYSA-N |
| SMILES: | | Software | SMILES |
|---|
| ACDLabs 12.01 | O=S(=O)(N)c2cccc(C(=O)CSc1ncccn1)c2 | | CACTVS 3.370 | N[S](=O)(=O)c1cccc(c1)C(=O)CSc2ncccn2 | | OpenEye OEToolkits 1.7.6 | c1cc(cc(c1)S(=O)(=O)N)C(=O)CSc2ncccn2 |
|
| Name: | 3-[(pyrimidin-2-ylsulfanyl)acetyl]benzenesulfonamide |
| ChEMBL: | CHEMBL2443189 |
| ZINC: | ZINC000095920725 |
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