A1JGN
Summary
| Name: | (4~{R})-~{N}-(3-cyclopropylphenyl)-2-oxidanylidene-3,4-dihydro-1~{H}-1,8-naphthyridine-4-carboxamide |
| Formula: | C18 H17 N3 O2 |
| Formal charge: | 0 |
| Formula weight: | 307.346 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | (4~{R})-~{N}-(3-cyclopropylphenyl)-2-oxidanylidene-3,4-dihydro-1~{H}-1,8-naphthyridine-4-carboxamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C18H17N3O2/c22-16-10-15(14-5-2-8-19-17(14)21-16)18(23)20-13-4-1-3-12(9-13)11-6-7-11/h1-5,8-9,11,15H,6-7,10H2,(H,20,23)(H,19,21,22)/t15-/m1/s1 |
| InChIKey | InChI | 1.06 | BALOQYJNAMGVIL-OAHLLOKOSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | O=C1C[C@@H](C(=O)Nc2cccc(c2)C3CC3)c4cccnc4N1 |
| SMILES | CACTVS | 3.385 | O=C1C[CH](C(=O)Nc2cccc(c2)C3CC3)c4cccnc4N1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cc(cc(c1)NC(=O)[C@@H]2CC(=O)Nc3c2cccn3)C4CC4 |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1cc(cc(c1)NC(=O)C2CC(=O)Nc3c2cccn3)C4CC4 |
