| PDB CCD ID: | BZN |
| Number of entries in BioLiP: | 2 |
| Chemical formula: | C23 H32 N2 O3 S |
| InChI: | InChI=1S/C23H32N2O3S/c1-19(2)15-25(29(26,27)23-11-7-4-8-12-23)16-21-13-24-14-22(21)18-28-17-20-9-5-3-6-10-20/h3-12,19,21-22,24H,13-18H2,1-2H3/t21-,22-/m1/s1 |
| InChIKey: | DGURGFSAQIBQCO-FGZHOGPDSA-N |
| SMILES: | | Software | SMILES |
|---|
| OpenEye OEToolkits 1.5.0 | CC(C)CN(CC1CNCC1COCc2ccccc2)S(=O)(=O)c3ccccc3 | | CACTVS 3.341 | CC(C)CN(C[CH]1CNC[CH]1COCc2ccccc2)[S](=O)(=O)c3ccccc3 | | CACTVS 3.341 | CC(C)CN(C[C@H]1CNC[C@@H]1COCc2ccccc2)[S](=O)(=O)c3ccccc3 | | ACDLabs 10.04 | O=S(=O)(c1ccccc1)N(CC(C)C)CC3CNCC3COCc2ccccc2 | | OpenEye OEToolkits 1.5.0 | CC(C)CN(C[C@H]1CNC[C@@H]1COCc2ccccc2)S(=O)(=O)c3ccccc3 |
|
| Name: | N-({(3R,4R)-4-[(benzyloxy)methyl]pyrrolidin-3-yl}methyl)-N-(2-methylpropyl)benzenesulfonamide;
N-((3R,4R)-4-Benzyloxymethyl-pyrrolidin-3-ylmethyl)-N-isobutyl-benzene sulfonamide |
| DrugBank: | DB07505 |
| ZINC: | ZINC000053683066 |
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