G11
Summary
| Name: | 6-[5-(cyclopropylcarbamoyl)-2-methylphenyl]-N-(cyclopropylmethyl)pyridine-3-carboxamide |
| Formula: | C21 H23 N3 O2 |
| Formal charge: | 0 |
| Formula weight: | 349.426 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 11.02 | 6-[5-(cyclopropylcarbamoyl)-2-methylphenyl]-N-(cyclopropylmethyl)pyridine-3-carboxamide |
| OpenEye OEToolkits | 1.6.1 | 6-[5-(cyclopropylcarbamoyl)-2-methyl-phenyl]-N-(cyclopropylmethyl)pyridine-3-carboxamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 11.02 | O=C(NC1CC1)c2cc(c(cc2)C)c3ncc(cc3)C(=O)NCC4CC4 |
| SMILES_CANONICAL | CACTVS | 3.352 | Cc1ccc(cc1c2ccc(cn2)C(=O)NCC3CC3)C(=O)NC4CC4 |
| SMILES | CACTVS | 3.352 | Cc1ccc(cc1c2ccc(cn2)C(=O)NCC3CC3)C(=O)NC4CC4 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | Cc1ccc(cc1c2ccc(cn2)C(=O)NCC3CC3)C(=O)NC4CC4 |
| SMILES | OpenEye OEToolkits | 1.7.0 | Cc1ccc(cc1c2ccc(cn2)C(=O)NCC3CC3)C(=O)NC4CC4 |
| InChI | InChI | 1.03 | InChI=1S/C21H23N3O2/c1-13-2-5-15(21(26)24-17-7-8-17)10-18(13)19-9-6-16(12-22-19)20(25)23-11-14-3-4-14/h2,5-6,9-10,12,14,17H,3-4,7-8,11H2,1H3,(H,23,25)(H,24,26) |
| InChIKey | InChI | 1.03 | WIXHEGLMUQGJCC-UHFFFAOYSA-N |
