72N
Summary
| Name: | 3-cyclopropyl-5-methyl-4-phenyl-1,2,4-triazole |
| Formula: | C12 H13 N3 |
| Formal charge: | 0 |
| Formula weight: | 199.252 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.5 | 3-cyclopropyl-5-methyl-4-phenyl-1,2,4-triazole |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C12H13N3/c1-9-13-14-12(10-7-8-10)15(9)11-5-3-2-4-6-11/h2-6,10H,7-8H2,1H3 |
| InChIKey | InChI | 1.03 | NNSGFXSZQIRXDG-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cc1nnc(C2CC2)n1c3ccccc3 |
| SMILES | CACTVS | 3.385 | Cc1nnc(C2CC2)n1c3ccccc3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.5 | Cc1nnc(n1c2ccccc2)C3CC3 |
| SMILES | OpenEye OEToolkits | 2.0.5 | Cc1nnc(n1c2ccccc2)C3CC3 |
