| PDB CCD ID: | 7R4 |
| Number of entries in BioLiP: | 1 |
| Chemical formula: | C10 H9 N O S2 |
| InChI: | InChI=1S/C10H9NOS2/c12-9-8(14-10(13)11-9)6-7-4-2-1-3-5-7/h1-5,8H,6H2,(H,11,12,13)/t8-/m1/s1 |
| InChIKey: | HEFVAMUJRPNDFW-MRVPVSSYSA-N |
| SMILES: | | Software | SMILES |
|---|
| ACDLabs 12.01 | c1ccc(cc1)CC2C(NC(=S)S2)=O | | OpenEye OEToolkits 2.0.6 | c1ccc(cc1)C[C@@H]2C(=O)NC(=S)S2 | | CACTVS 3.385 | O=C1NC(=S)S[CH]1Cc2ccccc2 | | CACTVS 3.385 | O=C1NC(=S)S[C@@H]1Cc2ccccc2 | | OpenEye OEToolkits 2.0.6 | c1ccc(cc1)CC2C(=O)NC(=S)S2 |
|
| Name: | (5R)-5-benzyl-2-sulfanylidene-1,3-thiazolidin-4-one |
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