P7R
Summary
| Name: | (4R)-6-chloro-N-(1-methyl-2-oxo-2,3-dihydro-1H-imidazo[4,5-c]pyridin-7-yl)-3,4-dihydro-2H-1-benzopyran-4-carboxamide |
| Formula: | C17 H15 Cl N4 O3 |
| Formal charge: | 0 |
| Formula weight: | 358.779 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | (4R)-6-chloro-N-(1-methyl-2-oxo-2,3-dihydro-1H-imidazo[4,5-c]pyridin-7-yl)-3,4-dihydro-2H-1-benzopyran-4-carboxamide |
| OpenEye OEToolkits | 2.0.7 | (4~{R})-6-chloranyl-~{N}-(1-methyl-2-oxidanylidene-3~{H}-imidazo[4,5-c]pyridin-7-yl)-3,4-dihydro-2~{H}-chromene-4-carboxamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | CN1c2c(NC1=O)cncc2NC(=O)C1CCOc2ccc(Cl)cc21 |
| InChI | InChI | 1.06 | InChI=1S/C17H15ClN4O3/c1-22-15-12(7-19-8-13(15)21-17(22)24)20-16(23)10-4-5-25-14-3-2-9(18)6-11(10)14/h2-3,6-8,10H,4-5H2,1H3,(H,20,23)(H,21,24)/t10-/m1/s1 |
| InChIKey | InChI | 1.06 | YNHUBGVMTXFOMC-SNVBAGLBSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CN1C(=O)Nc2cncc(NC(=O)[C@@H]3CCOc4ccc(Cl)cc34)c12 |
| SMILES | CACTVS | 3.385 | CN1C(=O)Nc2cncc(NC(=O)[CH]3CCOc4ccc(Cl)cc34)c12 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CN1c2c(cncc2NC(=O)[C@@H]3CCOc4c3cc(cc4)Cl)NC1=O |
| SMILES | OpenEye OEToolkits | 2.0.7 | CN1c2c(cncc2NC(=O)C3CCOc4c3cc(cc4)Cl)NC1=O |
