TEK
Summary
Name: | ~{N}-(1-ethylbenzimidazol-2-yl)ethanamide |
Formula: | C11 H13 N3 O |
Formal charge: | 0 |
Formula weight: | 203.24 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.7 | ~{N}-(1-ethylbenzimidazol-2-yl)ethanamide |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C11H13N3O/c1-3-14-10-7-5-4-6-9(10)13-11(14)12-8(2)15/h4-7H,3H2,1-2H3,(H,12,13,15) |
InChIKey | InChI | 1.03 | CTAOPYAHPUKQBH-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CCn1c(NC(C)=O)nc2ccccc12 |
SMILES | CACTVS | 3.385 | CCn1c(NC(C)=O)nc2ccccc12 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCn1c2ccccc2nc1NC(=O)C |
SMILES | OpenEye OEToolkits | 2.0.7 | CCn1c2ccccc2nc1NC(=O)C |