| PDB CCD ID: | WHS |
| Number of entries in BioLiP: | 1 |
| Chemical formula: | C9 H14 N2 O S |
| InChI: | InChI=1S/C9H14N2OS/c1-7-6-13-9(11-7)10-5-8-3-2-4-12-8/h6,8H,2-5H2,1H3,(H,10,11)/t8-/m1/s1 |
| InChIKey: | VWLMRMKWLYRBMA-MRVPVSSYSA-N |
| SMILES: | | Software | SMILES |
|---|
| ACDLabs 12.01 | n1c(C)csc1NCC2CCCO2 | | OpenEye OEToolkits 2.0.7 | Cc1csc(n1)NC[C@H]2CCCO2 | | CACTVS 3.385 | Cc1csc(NC[CH]2CCCO2)n1 | | OpenEye OEToolkits 2.0.7 | Cc1csc(n1)NCC2CCCO2 | | CACTVS 3.385 | Cc1csc(NC[C@H]2CCCO2)n1 |
|
| Name: | 4-methyl-N-{[(2R)-oxolan-2-yl]methyl}-1,3-thiazol-2-amine |
| ZINC: | ZINC000021013646 |
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