39O
Summary
| Name: | 5-amino-1,3,6-trimethyl-1,3-dihydro-2H-benzimidazol-2-one |
| Formula: | C10 H13 N3 O |
| Formal charge: | 0 |
| Formula weight: | 191.23 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 5-amino-1,3,6-trimethyl-1,3-dihydro-2H-benzimidazol-2-one |
| OpenEye OEToolkits | 1.9.2 | 5-azanyl-1,3,6-trimethyl-benzimidazol-2-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C2N(c1cc(c(cc1N2C)N)C)C |
| InChI | InChI | 1.03 | InChI=1S/C10H13N3O/c1-6-4-8-9(5-7(6)11)13(3)10(14)12(8)2/h4-5H,11H2,1-3H3 |
| InChIKey | InChI | 1.03 | DHPXTEFKFUCWDK-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CN1C(=O)N(C)c2cc(N)c(C)cc12 |
| SMILES | CACTVS | 3.385 | CN1C(=O)N(C)c2cc(N)c(C)cc12 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | Cc1cc2c(cc1N)N(C(=O)N2C)C |
| SMILES | OpenEye OEToolkits | 1.9.2 | Cc1cc2c(cc1N)N(C(=O)N2C)C |
