S0D
Summary
| Name: | 2-(1-methyl-1H-pyrazol-4-yl)-1H-benzimidazole |
| Formula: | C11 H10 N4 |
| Formal charge: | 0 |
| Formula weight: | 198.224 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 2-(1-methyl-1H-pyrazol-4-yl)-1H-benzimidazole |
| OpenEye OEToolkits | 1.7.6 | 2-(1-methylpyrazol-4-yl)-1H-benzimidazole |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | n3cc(c1nc2c(n1)cccc2)cn3C |
| InChI | InChI | 1.03 | InChI=1S/C11H10N4/c1-15-7-8(6-12-15)11-13-9-4-2-3-5-10(9)14-11/h2-7H,1H3,(H,13,14) |
| InChIKey | InChI | 1.03 | ILAJBGJRKOVOJZ-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cn1cc(cn1)c2[nH]c3ccccc3n2 |
| SMILES | CACTVS | 3.385 | Cn1cc(cn1)c2[nH]c3ccccc3n2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | Cn1cc(cn1)c2[nH]c3ccccc3n2 |
| SMILES | OpenEye OEToolkits | 1.7.6 | Cn1cc(cn1)c2[nH]c3ccccc3n2 |
