| PDB CCD ID: | FIG |
| Number of entries in BioLiP: | 1 |
| Chemical formula: | C13 H10 N2 O4 S |
| InChI: | InChI=1S/C13H10N2O4S/c16-10(8-4-2-1-3-5-8)7-20-13-14-6-9(12(18)19)11(17)15-13/h1-6H,7H2,(H,18,19)(H,14,15,17) |
| InChIKey: | NAHGGWKCMVAKPT-UHFFFAOYSA-N |
| SMILES: | | Software | SMILES |
|---|
| OpenEye OEToolkits 1.7.6 | c1ccc(cc1)C(=O)CSC2=NC=C(C(=O)N2)C(=O)O | | ACDLabs 12.01 | C(SC1=NC=C(C(O)=O)C(N1)=O)C(=O)c2ccccc2 | | CACTVS 3.385 | OC(=O)C1=CN=C(NC1=O)SCC(=O)c2ccccc2 |
|
| Name: | 6-oxo-2-[(2-oxo-2-phenylethyl)sulfanyl]-1,6-dihydropyrimidine-5-carboxylic acid |
| ChEMBL: | CHEMBL5081435 |
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