A1IAR
Summary
| Name: | 3-methyl-2-(prop-2-ynoxymethyl)imidazol-4-amine |
| Formula: | C8 H11 N3 O |
| Formal charge: | 0 |
| Formula weight: | 165.192 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 3-methyl-2-(prop-2-ynoxymethyl)imidazol-4-amine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C8H11N3O/c1-3-4-12-6-8-10-5-7(9)11(8)2/h1,5H,4,6,9H2,2H3 |
| InChIKey | InChI | 1.06 | JGQPVNNBPSNUGF-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cn1c(N)cnc1COCC#C |
| SMILES | CACTVS | 3.385 | Cn1c(N)cnc1COCC#C |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | Cn1c(cnc1COCC#C)N |
| SMILES | OpenEye OEToolkits | 2.0.7 | Cn1c(cnc1COCC#C)N |
