Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | Clc1cccc(c1)CC(=O)Nc1cncc2ccc(C)cc21 |
InChI | InChI | 1.06 | InChI=1S/C18H15ClN2O/c1-12-5-6-14-10-20-11-17(16(14)7-12)21-18(22)9-13-3-2-4-15(19)8-13/h2-8,10-11H,9H2,1H3,(H,21,22) |
InChIKey | InChI | 1.06 | BSUXNZPXAUGDQM-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | Cc1ccc2cncc(NC(=O)Cc3cccc(Cl)c3)c2c1 |
SMILES | CACTVS | 3.385 | Cc1ccc2cncc(NC(=O)Cc3cccc(Cl)c3)c2c1 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | Cc1ccc2cncc(c2c1)NC(=O)Cc3cccc(c3)Cl |
SMILES | OpenEye OEToolkits | 2.0.7 | Cc1ccc2cncc(c2c1)NC(=O)Cc3cccc(c3)Cl |