| PDB CCD ID: | 4IQ |
| Number of entries in BioLiP: | 1 |
| Chemical formula: | C19 H25 N3 O4 S2 |
| InChI: | InChI=1S/C19H25N3O4S2/c1-16-2-4-18(5-3-16)14-21-12-13-27(23,24)22(15-21)11-10-17-6-8-19(9-7-17)28(20,25)26/h2-9H,10-15H2,1H3,(H2,20,25,26) |
| InChIKey: | RGMYFIVOQGMVRR-UHFFFAOYSA-N |
| SMILES: | | Software | SMILES |
|---|
| CACTVS 3.385 | Cc1ccc(CN2CC[S](=O)(=O)N(CCc3ccc(cc3)[S](N)(=O)=O)C2)cc1 | | OpenEye OEToolkits 2.0.7 | Cc1ccc(cc1)CN2CCS(=O)(=O)N(C2)CCc3ccc(cc3)S(=O)(=O)N |
|
| Name: | 4-[2-[4-[(4-methylphenyl)methyl]-1,1-bis(oxidanylidene)-1,2,4-thiadiazinan-2-yl]ethyl]benzenesulfonamide |
| ChEMBL: | CHEMBL4870611 |
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