Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=C(Nc1cnccc1c1ccccc1)Cc1cccc(Cl)c1 |
InChI | InChI | 1.06 | InChI=1S/C19H15ClN2O/c20-16-8-4-5-14(11-16)12-19(23)22-18-13-21-10-9-17(18)15-6-2-1-3-7-15/h1-11,13H,12H2,(H,22,23) |
InChIKey | InChI | 1.06 | VSOZJTYJJHNDPD-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | Clc1cccc(CC(=O)Nc2cnccc2c3ccccc3)c1 |
SMILES | CACTVS | 3.385 | Clc1cccc(CC(=O)Nc2cnccc2c3ccccc3)c1 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1ccc(cc1)c2ccncc2NC(=O)Cc3cccc(c3)Cl |
SMILES | OpenEye OEToolkits | 2.0.7 | c1ccc(cc1)c2ccncc2NC(=O)Cc3cccc(c3)Cl |