EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C17H21N3O5S3 |
| Net Charge | 0 |
| Average Mass | 443.572 |
| Monoisotopic Mass | 443.06433 |
| SMILES | CCOC(=O)c1sc2nc(C)nc(SCC(=O)NC3CCS(=O)(=O)C3)c2c1C |
| InChI | InChI=1S/C17H21N3O5S3/c1-4-25-17(22)14-9(2)13-15(18-10(3)19-16(13)27-14)26-7-12(21)20-11-5-6-28(23,24)8-11/h11H,4-8H2,1-3H3,(H,20,21) |
| InChIKey | DDKHDACZNQQLTQ-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 4-[[2-[(1,1-dioxo-3-thiolanyl)amino]-2-oxoethyl]thio]-2,5-dimethyl-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester (CHEBI:121902) is a organic heterobicyclic compound (CHEBI:27171) |
| 4-[[2-[(1,1-dioxo-3-thiolanyl)amino]-2-oxoethyl]thio]-2,5-dimethyl-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester (CHEBI:121902) is a organonitrogen heterocyclic compound (CHEBI:38101) |
| 4-[[2-[(1,1-dioxo-3-thiolanyl)amino]-2-oxoethyl]thio]-2,5-dimethyl-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester (CHEBI:121902) is a organosulfur heterocyclic compound (CHEBI:38106) |
| 4-[[2-[(1,1-dioxo-3-thiolanyl)amino]-2-oxoethyl]thio]-2,5-dimethyl-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester (CHEBI:121902) is a thienopyrimidine (CHEBI:143212) |
| Manual Xrefs | Databases |
|---|---|
| LSM-33345 | LINCS |