7WA
Summary
| Name: | 1H-benzimidazol-4-amine |
| Formula: | C7 H7 N3 |
| Formal charge: | 0 |
| Formula weight: | 133.151 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 1H-benzimidazol-4-amine |
| OpenEye OEToolkits | 2.0.6 | 1~{H}-benzimidazol-4-amine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | c21c(cccc1N)ncn2 |
| InChI | InChI | 1.03 | InChI=1S/C7H7N3/c8-5-2-1-3-6-7(5)10-4-9-6/h1-4H,8H2,(H,9,10) |
| InChIKey | InChI | 1.03 | NZJKEQFPRPAEPO-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Nc1cccc2[nH]cnc12 |
| SMILES | CACTVS | 3.385 | Nc1cccc2[nH]cnc12 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | c1cc(c2c(c1)[nH]cn2)N |
| SMILES | OpenEye OEToolkits | 2.0.6 | c1cc(c2c(c1)[nH]cn2)N |
