A1A6F
Summary
| Name: | (8R)-3-(1,3-benzothiazol-2-yl)pyrazolo[1,5-a]pyrimidine |
| Formula: | C13 H8 N4 S |
| Formal charge: | 0 |
| Formula weight: | 252.294 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 14.52 | (8R)-3-(1,3-benzothiazol-2-yl)pyrazolo[1,5-a]pyrimidine |
| OpenEye OEToolkits | 2.0.7 | 2-pyrazolo[1,5-a]pyrimidin-3-yl-1,3-benzothiazole |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | c1cccc2sc(nc12)c1cnn2cccnc21 |
| InChI | InChI | 1.06 | InChI=1S/C13H8N4S/c1-2-5-11-10(4-1)16-13(18-11)9-8-15-17-7-3-6-14-12(9)17/h1-8H |
| InChIKey | InChI | 1.06 | SAZAMNXEWSKXHU-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | s1c2ccccc2nc1c3cnn4cccnc34 |
| SMILES | CACTVS | 3.385 | s1c2ccccc2nc1c3cnn4cccnc34 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1ccc2c(c1)nc(s2)c3cnn4c3nccc4 |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1ccc2c(c1)nc(s2)c3cnn4c3nccc4 |
