Obsolete: HII
Summary
| Name: | 2-METHYL-3-(2-AMINOTHIAZOLO)PROPANAL |
| Formula: | C7 H10 N2 O S |
| Formal charge: | 0 |
| Formula weight: | 170.232 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | (2S)-3-(2-amino-1,3-thiazol-4-yl)-2-methylpropanal |
| OpenEye OEToolkits | 1.5.0 | (2S)-3-(2-amino-1,3-thiazol-4-yl)-2-methyl-propanal |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=CC(C)Cc1nc(sc1)N |
| SMILES_CANONICAL | CACTVS | 3.341 | C[C@@H](Cc1csc(N)n1)C=O |
| SMILES | CACTVS | 3.341 | C[CH](Cc1csc(N)n1)C=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C[C@@H](Cc1csc(n1)N)C=O |
| SMILES | OpenEye OEToolkits | 1.5.0 | CC(Cc1csc(n1)N)C=O |
| InChI | InChI | 1.03 | InChI=1S/C7H10N2OS/c1-5(3-10)2-6-4-11-7(8)9-6/h3-5H,2H2,1H3,(H2,8,9)/t5-/m0/s1 |
| InChIKey | InChI | 1.03 | KFMAJVLZSDMFBV-YFKPBYRVSA-N |
