| PDB CCD ID: | 4VK |
| Number of entries in BioLiP: | 1 |
| Chemical formula: | C20 H19 N O3 S |
| InChI: | InChI=1S/C20H19NO3S/c22-15-17-5-4-6-19(13-17)18-11-9-16(10-12-18)14-21-25(23,24)20-7-2-1-3-8-20/h1-13,21-22H,14-15H2 |
| InChIKey: | COEMTPKQUSKJIS-UHFFFAOYSA-N |
| SMILES: | | Software | SMILES |
|---|
| ACDLabs 12.01 | c3cc(S(=O)(=O)NCc2ccc(c1cc(ccc1)CO)cc2)ccc3 | | CACTVS 3.385 | OCc1cccc(c1)c2ccc(CN[S](=O)(=O)c3ccccc3)cc2 | | OpenEye OEToolkits 1.9.2 | c1ccc(cc1)S(=O)(=O)NCc2ccc(cc2)c3cccc(c3)CO |
|
| Name: | N-{[3'-(hydroxymethyl)biphenyl-4-yl]methyl}benzenesulfonamide |
| ZINC: | ZINC000584905110 |
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