QCU
Summary
Name: | 1,3-dimethylbenzimidazol-2-one |
Formula: | C9 H10 N2 O |
Formal charge: | 0 |
Formula weight: | 162.188 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 3.1.0.0 | 1,3-dimethylbenzimidazol-2-one |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.06 | InChI=1S/C9H10N2O/c1-10-7-5-3-4-6-8(7)11(2)9(10)12/h3-6H,1-2H3 |
InChIKey | InChI | 1.06 | NOJXCBIUEXCLMZ-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CN1C(=O)N(C)c2ccccc12 |
SMILES | CACTVS | 3.385 | CN1C(=O)N(C)c2ccccc12 |
SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | CN1c2ccccc2N(C1=O)C |
SMILES | OpenEye OEToolkits | 3.1.0.0 | CN1c2ccccc2N(C1=O)C |