| PDB CCD ID: | RSL |
| Number of entries in BioLiP: | 1 |
| Chemical formula: | C18 H15 Cl N2 O4 S |
| InChI: | InChI=1S/C18H15ClN2O4S/c1-26(23,24)25-15-5-6-16-13(9-15)10-20-11-17(16)21-18(22)8-12-3-2-4-14(19)7-12/h2-7,9-11H,8H2,1H3,(H,21,22) |
| InChIKey: | DLGHRHRFJGLPSU-UHFFFAOYSA-N |
| SMILES: | | Software | SMILES |
|---|
| ACDLabs 12.01 | Clc1cccc(c1)CC(=O)Nc1cncc2cc(ccc21)OS(C)(=O)=O | | OpenEye OEToolkits 2.0.7 | CS(=O)(=O)Oc1ccc2c(c1)cncc2NC(=O)Cc3cccc(c3)Cl | | CACTVS 3.385 | C[S](=O)(=O)Oc1ccc2c(NC(=O)Cc3cccc(Cl)c3)cncc2c1 |
|
| Name: | 4-[2-(3-chlorophenyl)acetamido]isoquinolin-7-yl methanesulfonate |
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