PWX
Summary
| Name: | 7-chloro-1-methyl-1H-benzimidazol-2-amine |
| Formula: | C8 H8 Cl N3 |
| Formal charge: | 0 |
| Formula weight: | 181.622 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 7-chloro-1-methyl-1H-benzimidazol-2-amine |
| OpenEye OEToolkits | 2.0.7 | 7-chloranyl-1-methyl-benzimidazol-2-amine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | Clc1cccc2nc(N)n(C)c12 |
| InChI | InChI | 1.03 | InChI=1S/C8H8ClN3/c1-12-7-5(9)3-2-4-6(7)11-8(12)10/h2-4H,1H3,(H2,10,11) |
| InChIKey | InChI | 1.03 | SXLPXHZFEJYXBB-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cn1c(N)nc2cccc(Cl)c12 |
| SMILES | CACTVS | 3.385 | Cn1c(N)nc2cccc(Cl)c12 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | Cn1c2c(cccc2Cl)nc1N |
| SMILES | OpenEye OEToolkits | 2.0.7 | Cn1c2c(cccc2Cl)nc1N |
