PDB CCD ID: | 2J9 |
Number of entries in BioLiP: | 75 |
Chemical formula: | C10 H11 F N2 O2 S |
InChI: | InChI=1S/C10H11FN2O2S/c11-7-1-4-9-10(5-7)16(14,15)12-6-13(9)8-2-3-8/h1,4-5,8,12H,2-3,6H2 |
InChIKey: | FLTMTBPCYAZIKM-UHFFFAOYSA-N |
SMILES: | Software | SMILES |
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ACDLabs 12.01 | Fc1ccc2c(c1)S(=O)(=O)NCN2C3CC3 | CACTVS 3.385 | Fc1ccc2N(CN[S](=O)(=O)c2c1)C3CC3 | OpenEye OEToolkits 1.7.6 | c1cc2c(cc1F)S(=O)(=O)NCN2C3CC3 |
|
Name: | 4-cyclopropyl-7-fluoro-3,4-dihydro-2H-1,2,4-benzothiadiazine 1,1-dioxide |
ChEMBL: | CHEMBL2441067 |
ZINC: | ZINC000095921421 |