6HD
Summary
| Name: | 2-(methylamino)-1H-benzimidazole-5-carboxamide |
| Formula: | C9 H10 N4 O |
| Formal charge: | 0 |
| Formula weight: | 190.202 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 2-(methylamino)-1H-benzimidazole-5-carboxamide |
| OpenEye OEToolkits | 2.0.4 | 2-(methylamino)-1~{H}-benzimidazole-5-carboxamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(N)c1ccc2c(c1)nc(n2)NC |
| InChI | InChI | 1.03 | InChI=1S/C9H10N4O/c1-11-9-12-6-3-2-5(8(10)14)4-7(6)13-9/h2-4H,1H3,(H2,10,14)(H2,11,12,13) |
| InChIKey | InChI | 1.03 | LOKXPWIZESGCLZ-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CNc1[nH]c2ccc(cc2n1)C(N)=O |
| SMILES | CACTVS | 3.385 | CNc1[nH]c2ccc(cc2n1)C(N)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.4 | CNc1[nH]c2ccc(cc2n1)C(=O)N |
| SMILES | OpenEye OEToolkits | 2.0.4 | CNc1[nH]c2ccc(cc2n1)C(=O)N |
