Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C19H21N5O/c1-14-19(22-13-21-14)15-6-7-20-18(12-15)23-16-2-4-17(5-3-16)24-8-10-25-11-9-24/h2-7,12-13H,8-11H2,1H3,(H,20,23)(H,21,22) |
InChIKey | InChI | 1.03 | KJQAULYFYNEAHK-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | Cc1nc[nH]c1c2ccnc(Nc3ccc(cc3)N4CCOCC4)c2 |
SMILES | CACTVS | 3.385 | Cc1nc[nH]c1c2ccnc(Nc3ccc(cc3)N4CCOCC4)c2 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | Cc1c([nH]cn1)c2ccnc(c2)Nc3ccc(cc3)N4CCOCC4 |
SMILES | OpenEye OEToolkits | 2.0.6 | Cc1c([nH]cn1)c2ccnc(c2)Nc3ccc(cc3)N4CCOCC4 |