Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=C(Cc1ccc(cc1)C1=NNC(=O)c2ccccc21)N1CCc2ccccc21 |
InChI | InChI | 1.06 | InChI=1S/C24H19N3O2/c28-22(27-14-13-17-5-1-4-8-21(17)27)15-16-9-11-18(12-10-16)23-19-6-2-3-7-20(19)24(29)26-25-23/h1-12H,13-15H2,(H,26,29) |
InChIKey | InChI | 1.06 | COYVFENBIAJDFY-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | O=C(Cc1ccc(cc1)C2=NNC(=O)c3ccccc23)N4CCc5ccccc45 |
SMILES | CACTVS | 3.385 | O=C(Cc1ccc(cc1)C2=NNC(=O)c3ccccc23)N4CCc5ccccc45 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1ccc2c(c1)CCN2C(=O)Cc3ccc(cc3)C4=NNC(=O)c5c4cccc5 |
SMILES | OpenEye OEToolkits | 2.0.7 | c1ccc2c(c1)CCN2C(=O)Cc3ccc(cc3)C4=NNC(=O)c5c4cccc5 |