| PDB CCD ID: | SNH |
| Number of entries in BioLiP: | 2 |
| Chemical formula: | C19 H17 N O5 S3 |
| InChI: | InChI=1S/C19H17NO5S3/c1-10-4-7-17(11(2)8-10)28(24,25)20-13-9-16(27-18(13)19(22)23)15-6-5-14(26-15)12(3)21/h4-9,20H,1-3H3,(H,22,23) |
| InChIKey: | CMHHNHDPPWDNAH-UHFFFAOYSA-N |
| SMILES: | | Software | SMILES |
|---|
| CACTVS 3.341 | CC(=O)c1sc(cc1)c2sc(C(O)=O)c(N[S](=O)(=O)c3ccc(C)cc3C)c2 | | OpenEye OEToolkits 1.5.0 | Cc1ccc(c(c1)C)S(=O)(=O)Nc2cc(sc2C(=O)O)c3ccc(s3)C(=O)C | | ACDLabs 10.04 | O=C(O)c2sc(cc2NS(=O)(=O)c1ccc(cc1C)C)c3sc(C(=O)C)cc3 |
|
| Name: | 5'-ACETYL-4-{[(2,4-DIMETHYLPHENYL)SULFONYL]AMINO}-2,2'-BITHIOPHENE-5-CARBOXYLIC ACID |
| DrugBank: | DB08556 |
| ZINC: | ZINC000016051918 |
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