| PDB CCD ID: | Y4E |
| Number of entries in BioLiP: | 3 |
| Chemical formula: | C10 H12 N2 S2 |
| InChI: | InChI=1S/C10H12N2S2/c13-5-10-12-8-4-2-1-3-7(8)11-9(12)6-14-10/h1-4,9-11,13H,5-6H2/t9-,10-/m1/s1 |
| InChIKey: | PBXWHODMWKJRIF-NXEZZACHSA-N |
| SMILES: | | Software | SMILES |
|---|
| OpenEye OEToolkits 2.0.7 | c1ccc2c(c1)NC3N2C(SC3)CS | | OpenEye OEToolkits 2.0.7 | c1ccc2c(c1)N[C@@H]3N2[C@H](SC3)CS | | CACTVS 3.385 | SC[CH]1SC[CH]2Nc3ccccc3N12 | | CACTVS 3.385 | SC[C@H]1SC[C@@H]2Nc3ccccc3N12 |
|
| Name: | [(1~{R},3~{a}~{R})-1,3,3~{a},4-tetrahydro-[1,3]thiazolo[3,4-a]benzimidazol-1-yl]methanethiol |
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