XBT
Summary
| Name: | 2-[(1R)-1-methylpropyl]-4,5-dihydro-1,3-thiazole |
| Synonyms: | 2-sec-butyl-4,5-dihydrothiazole |
| Formula: | C7 H13 N S |
| Formal charge: | 0 |
| Formula weight: | 143.25 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 1.6.1 | 2-[(2R)-butan-2-yl]-4,5-dihydro-1,3-thiazole |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES_CANONICAL | CACTVS | 3.352 | CC[C@@H](C)C1=NCCS1 |
| SMILES | CACTVS | 3.352 | CC[CH](C)C1=NCCS1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | CC[C@@H](C)C1=NCCS1 |
| SMILES | OpenEye OEToolkits | 1.7.0 | CCC(C)C1=NCCS1 |
| InChI | InChI | 1.03 | InChI=1S/C7H13NS/c1-3-6(2)7-8-4-5-9-7/h6H,3-5H2,1-2H3/t6-/m1/s1 |
| InChIKey | InChI | 1.03 | SAWWKXMIPYUIBW-ZCFIWIBFSA-N |
